JAZL/ChemGist-CHON huggingface dataset:
Compound: SCHEMBL672425
SMILES: O=C(O[C@]1(c2ccccc2)[C@H](CN(C)CC1)CC)CC
InChIKey: ODEGQXRCQDVXSJ-YOEHRIQHSA-N
Synonyms: SCHEMBL672425, NS00079720, Q3221490
Theoretical properties:
molecular_formula: C17H25NO2
molecular_weight: 275.4 g/mol
exact_mass: 275.188529040 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 0
hydrogen_bond_acceptor_count: 3
rotatable_bond_count: 5
heavy_atom_count: 20
topological_polar_surface_area: 29.5 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
Descriptions:
Compound: aminoacetone
SMILES: O=C(CN)C
InChIKey: BCDGQXUMWHRQCB-UHFFFAOYSA-N
Synonyms: aminoacetone, 298-08-8, 1-Amino-2-propanone, ZB4ES38S4R, CHEBI:17906, DTXSID10183939, 1-aminopropanone, (2-oxopropyl)amine, RefChem:557528, DTXCID00106430, 1-aminopropan-2-one, 1-Aminoacetone, 2-Propanone, 1-amino-, alpha-Aminoacetone, MFCD00869738, UNII-ZB4ES38S4R, amino-2-propanone, 2-Propanone, amino-, amino-(6CI)-2-propanone, .ALPHA.-AMINOACETONE, SCHEMBL24849, SCHEMBL38702, SCHEMBL122773, 1-AMINO-PROPAN-2-ONE, 2-Propanone, amino- (6CI), SCHEMBL1403369, SCHEMBL2857347, BCDGQXUMWHRQCB-UHFFFAOYSA-N, 1-amino-(8CI,9CI)-2-propanone, AKOS010297672, 2-Propanone, 1-amino- (8CI,9CI), DB-050057, NS00120332, EN300-54739, C01888, D87844, Q4545767
Theoretical properties:
molecular_formula: C3H7NO
molecular_weight: 73.09 g/mol
exact_mass: 73.052763847 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 1
hydrogen_bond_acceptor_count: 2
rotatable_bond_count: 1
heavy_atom_count: 5
topological_polar_surface_area: 43.1 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
Descriptions:
pubchem: Aminoacetone is a propanone consisting of acetone having an amino group at the 1-position. It has a role as a mouse metabolite and an Escherichia coli metabolite. It is a member of propanones and a methyl ketone. It is functionally related to an acetone. It is a conjugate base of an ammonioacetone.
chebi: A propanone consisting of acetone having an amino group at the 1-position.
wikipedia: Aminoacetone is the organic compound with the formula CH3C(O)CH2NH2. Although stable in the gaseous form, once condensed it reacts with itself. The protonated derivative forms isolable salts, e.g. aminoacetone hydrochloride ([CH3C(O)CH2NH3]Cl)). The semicarbazone of the hydrochloride is another bench-stable precursor. Aminoacetone is a metabolite that is implicated in the biosynthesis of methylglyoxal.
Aminoacetone is also produced during catabolism of the amino acid threonine. Threonine is first dehydrogenated to 2-amino-3-oxobutyrate, which is unstable and spontaneously decarboxylates to aminoacetone. Aminoacetone is then oxidized and deaminated, giving 2-oxopropanal (methylglyoxal), which is in turn oxidized to pyruvate. This pathway is the most important catabolic pathway of threonine in mammals.
Compound: 1,2-Dioxin
SMILES: O1OC=CC=C1
InChIKey: VCZQYTJRWNRPHF-UHFFFAOYSA-N
Synonyms: 1,2-Dioxin, 289-87-2, R8H79L3J69, RefChem:1052310, o-Dioxin, 1,2-Dioxacyclohexadiene, UNII-R8H79L3J69, 1,2-dioxine, 2,3,7,8-dioxin, SCHEMBL8940, SCHEMBL23644, SCHEMBL1518002, SCHEMBL5950093, DTXSID90574144, Q161486
Theoretical properties:
molecular_formula: C4H4O2
molecular_weight: 84.07 g/mol
exact_mass: 84.021129366 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 0
hydrogen_bond_acceptor_count: 2
rotatable_bond_count: 0
heavy_atom_count: 6
topological_polar_surface_area: 18.5 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
Descriptions:
wikipedia: 1,2-Dioxin is a heterocyclic, organic, antiaromatic compound with the chemical formula C4H4O2. It is an isomeric form of 1,4-dioxin (or p-dioxin).

Due to its peroxide-like characteristics, 1,2-dioxin is very unstable and has not been isolated. Calculations suggest that it would isomerize rapidly into but-2-enedial. Even substituted derivatives, such as 1,4-diphenyl-2,3-benzodioxin, are very labile. 

In 1990, 3,6-bis(p-tolyl)-1,2-dioxin (1) was incorrectly reported as the first stable derivative. It was subsequently shown that the initial compound was not a derivative of 1,2-dioxin, but a thermodynamically more stable dione (2).
Compound: PIMINODINE
SMILES: O=C(OCC)C1(c2ccccc2)CCN(CCCNc3ccccc3)CC1
InChIKey: PXXKIYPSXYFATG-UHFFFAOYSA-N
Synonyms: PIMINODINE, Anopridine, Pimadine, Cimadon, Pimadin, Pimadin (analgesic), Piminodina, Piminodinum, 13495-09-5, 3IIX447HWS, 4-Piperidinecarboxylic acid, 4-phenyl-1-(3-(phenylamino)propyl)-, ethyl ester, IDS-NP-012, Isonipecotic acid, 1-(3-anilinopropyl)-4-phenyl-, ethyl ester, DTXSID60159149, 4-Piperidinecarboxylic acid, 4-phenyl-1-[3-(phenylamino)propyl]-, ethyl ester, RefChem:863298, DTXCID4081640, ethyl 1-(3-(phenylamino)propyl)-4-phenylpiperidine-4-carboxylate, 236-817-6, Alvodine, Piminodine [INN:BAN], Piminodinum [INN-Latin], Piminodina [INN-Spanish], NIH 7590, WIN 14098, WIN 14098-2, UNII-3IIX447HWS, EINECS 236-817-6, BRN 0334632, DEA No. 9730, 5-22-02-00490 (Beilstein Handbook Reference), Piminodine (INN), 4-Phenyl-1-(3-(phenylamino)propyl)-4-piperidinecarboxylic acid ethyl ester, PIMINODINE [INN], Piminodin, ethyl 1-(3-anilinopropyl)-4-phenylpiperidine-4-carboxylate, PIMINODINE [MI], PIMINODINE [WHO-DD], SCHEMBL26477, CHEMBL2110995, CHEBI:135546, HY-U00297, CS-7266, PIMINODINE ALVODINE,PIMADIN,CIMAPON, NS00010500, D12683, Q7194651, Ethyl 1-(3-anilinopropyl)-4-phenyl-4-piperidinecarboxylate #
Theoretical properties:
molecular_formula: C23H30N2O2
molecular_weight: 366.5 g/mol
exact_mass: 366.230728204 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 1
hydrogen_bond_acceptor_count: 4
rotatable_bond_count: 9
heavy_atom_count: 27
topological_polar_surface_area: 41.6 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
Descriptions:
pubchem: Piminodine is a member of piperidines.
chembl: PIMINODINE is a small molecule listed in the ChEMBL database and has reached clinical trial phase 2.0.
wikipedia: Piminodine (Alvodine) is an opioid analgesic that is an analogue of pethidine (meperidine). It was used in medicine briefly during the 1960s and 70s, but has largely fallen out of clinical use. It was used particularly for obstetric analgesia and in dental procedures and, like pethidine, could be combined with hydroxyzine to intensify the effects. The duration of action is 2–4 hours; 7.5–10 mg via the subcutaneous route is the most common starting dose, being equal to 80–100 mg of pethidine, 40–60 mg of alphaprodine and 10 mg of morphine. Oral formulations were also available.
Piminodine has similar effects to other opioids, and produces analgesia, sedation and euphoria. Side effects can include itching, nausea and potentially serious respiratory depression which can be life-threatening.
SMILES: O=c1n(ccc([nH]1)=O)[C@@H]2O[C@H](C(O)C[C@H]3O[C@@H](O[C@H]4O[C@@H]([C@@H](O)[C@@H]([C@H]4NC(=O)C)O)CO)[C@H](NC(=O)/C=C/CC(C)C)[C@H]([C@H]3O)O)[C@H]([C@H]2O)O
InChIKey: ZHSGGJXRNHWHRS-VIDYELAYSA-N
Theoretical properties:
Physical properties:
Descriptions:
Compound: ISOPROPYL PALMITATE
SMILES: O=C(OC(C)C)CCCCCCCCCCCCCCC
InChIKey: XUGNVMKQXJXZCD-UHFFFAOYSA-N
Synonyms: ISOPROPYL PALMITATE, 142-91-6, Isopropyl hexadecanoate, Hexadecanoic acid, 1-methylethyl ester, Isopalm, Emerest 2316, Wickenol 111, Deltyl, Isopal, Propal, Deltyl prime, Sinnoester PIT, Crodamol IPP, Kessco IPP, Tegester isopalm, Plymouth IPP, Starfol IPP, Unimate IPP, Nikkol IPP, Emcol-IP, Stepan D-70, Isopropyl n-hexadecanoate, Palmitic acid, isopropyl ester, 1-Methylethyl hexadecanoate, Estol 103, Usaf ke-5, propan-2-yl hexadecanoate, Kessco isopropyl palmitate, Hexadecanoic acid, isopropyl ester, Hariol ipp, DTXSID9027104, Estol 1517, 8CRQ2TH63M, NSC-69169, DTXCID507104, CHEBI:84262, Hexadecanoic acid 1-methylethyl ester, RefChem:5922, LANOMIZ COLLAGEN NIGHTWRAPPING MASK, 205-571-1, 692-042-7, Ja-fa ippkessco, JA-FA Ipp, Palmitic Acid Isopropyl Ester, 2-propyl hexadecanoate, Tegosoft P, Liponate IPP, Lexol IPP, MFCD00008993, NSC 69169, Isopropyl palmitate (NF), Isopropyl palmitate [NF], Isopropyl ester of hexadecanoic acid, NCGC00164128-01, WE(2:0(1Me)/16:0), CAS-142-91-6, HSDB 2647, EINECS 205-571-1, UNII-8CRQ2TH63M, BRN 1786567, AI3-05733, Hexadecanoic acid isopropyl ester, iso-propylpalmitate, isopropyl-palmitate, ISOPROPYLPALMITATE, Radia 7200, EC 205-571-1, Isopropyl hexadecanoate CRS, 1-methylethyl hexandecanoate, SCHEMBL7743, Palmitic acid-isopropyl ester, 4-02-00-01167 (Beilstein Handbook Reference), Isopropyl palmitate, >=90%, CHEMBL139055, orb1705865, SCHEMBL4433229, ISOPROPYL PALMITATE [II], SCHEMBL22077533, MSK1642, ISOPROPYL PALMITATE [HSDB], WLN: 15VOY1 & 1, ISOPROPYL PALMITATE [VANDF], ISOPROPYL PALMITATE [MART.], NSC69169, Tox21_112085, Tox21_202558, ISOPROPYL PALMITATE [USP-RS], ISOPROPYL PALMITATE [WHO-DD], LMFA07010675, AKOS015902011, Tox21_112085_1, CS-W012142, HY-W011426, ISOPROPYL PALMITATE [EP IMPURITY], NCGC00164128-02, NCGC00260107-01, BS-15396, Hexadecanoic acidisopropyl n-hexadecanoate, ISOPROPYL PALMITATE [EP MONOGRAPH], MSK1642-1000, Isopropyl palmitate, technical grade, 90%, DB-042654, NS00009869, P0005, 1-Methylethyl ester1-methylethyl hexandecanoate, D04632, SBI-0654057.0001, F546546, SR-01000944752, Isopropyl palmitate Solution in Acetone, 1000?g/mL, Q2631777, SR-01000944752-1, BRD-K30758549-001-01-8, Isopropyl hexadecanoate, European Pharmacopoeia (EP) Reference Standard, Isopropyl palmitate, United States Pharmacopeia (USP) Reference Standard, Isopropyl palmitate, Pharmaceutical Secondary Standard; Certified Reference Material
Theoretical properties:
Physical properties:
Descriptions:
chebi: A fatty acid ester obtained by the formal condensation of carboxy group of palmitic acid with  propan-2-ol. Metabolite observed in cancer metabolism.
chembl: ISOPROPYL PALMITATE is a small molecule listed in the ChEMBL database and has reached clinical trial phase -1.0.
wikipedia: Isopropyl palmitate is the ester of isopropyl alcohol and palmitic acid. It is an emollient, moisturizer, thickening agent, and anti-static agent. The chemical formula is CH3(CH2)14COOCH(CH3)2.
Compound: 2,3-butanediol
SMILES: OC(C(O)C)C
InChIKey: OWBTYPJTUOEWEK-UHFFFAOYSA-N
Synonyms: 2,3-butanediol, 513-85-9, Butane-2,3-diol, 2,3-butylene glycol, 2,3-Dihydroxybutane, Dimethylethylene glycol, Pseudobutylene glycol, Sym-dimethylethylene glycol, DTXSID8041321, DTXCID6021321, CHEBI:62064, 45427ZB5IJ, RefChem:441921, 208-173-6, DL-2,3-Butanediol, 123513-85-9, MFCD00004523, NISTC6982258, 2,3-Butanediol, (R*,R*)-(.+/-.)-, 2,3-butanodiol, 35007-63-7, Butan-2,3-diol, CCRIS 5501, HSDB 1505, EINECS 208-173-6, BRN 0969165, 2,3-Butanediol; >98%, UNII-45427ZB5IJ, (+/-)-2,3-BUTANEDIOL, (S,S)-(+)-2,3-Butylene Glycol, NSC-249246, 2.3-butanediol, 2,3-butane diol, butane 2,3-diol, 2,3-Butandiol, a 2,3-butanediol, 2d-Pharmalyte(9ci), a butane-2,3-diol, dimethyl ethyleneglycol, 2,3-dihydroxy butane, 2,3-dihydroxy-butane, D-2,3-Butane diol, dimethyl ethylene glycol, levo-butane-2,3-diol, meso-2,3-butane diol, a 2,3-butylene glycol, 2,3-Butanediol (DL), GlyTouCan:G30201QD, 2,3-Butanediol, 98%, DL-2,3-BUTANDIOL, EC 208-173-6, 2,3-Butanediol (Standard), SCHEMBL22162, SCHEMBL39387, SCHEMBL39601, 4-01-00-02524 (Beilstein Handbook Reference), SCHEMBL757022, orb1307137, orb3139131, SCHEMBL1669550, SCHEMBL2496478, SCHEMBL8675003, CHEMBL2312529, SCHEMBL15012273, G30201QD, Tox21_300789, MSK9025-100M, NSC249246, AKOS009031391, MSK9025-1000M, EBC-153106, HY-128387R, SB44226, SB44692, NCGC00248169-01, NCGC00254693-01, 2,3-Butanediol(mixture of stereoisomers), CAS-513-85-9, FB146503, 2,3-Butanediol (mixture of stereoisomers), DB-027533, DB-243178, DB-335823, HY-128387, B0681, CS-0099502, NS00077458, S6040, EN300-19321, F14836, 2,3-Butanediol Solution in Methanol, 100ug/mL, 2,3-Butanediol, Vetec(TM) reagent grade, 98%, 2,3-Butanediol Solution in Methanol, 1000ug/mL, F114700, Q209157, F0001-1337, Z104473532, InChI=1/C4H10O2/c1-3(5)4(2)6/h3-6H,1-2H, 34439-75-3
Theoretical properties:
molecular_formula: C4H10O2
molecular_weight: 90.12 g/mol
exact_mass: 90.068079557 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 2
hydrogen_bond_acceptor_count: 2
rotatable_bond_count: 1
heavy_atom_count: 6
topological_polar_surface_area: 40.5 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
physical_state: Nearly colorless, crystalline solid or liquid
color: Nearly colorless, crystalline solid or liquid
odor: Odorless
boiling_point: BP: 182 °C at 1 atm
melting_point: 19 °C
density: 1.045 at 20 °C/20 °C
solubility: In water, miscible at 20 °C
flash_point: 85 °C
vapor_pressure: 0.24 [mmHg]
Descriptions:
pubchem: Butane-2,3-diol is a butanediol in which hydroxylation is at C-2 and C-3. It is a glycol, a secondary alcohol and a butanediol.
chebi: A butanediol in which hydroxylation is at C-2 and C-3.
chembl: Unnamed Compound is a small molecule listed in the ChEMBL database but has not progressed to an approved clinical phase.
wikipedia: 2,3-Butanediol is the organic compound with the formula (CH3CHOH)2.  It is classified as a vic-diol (glycol).  It exists as three stereoisomers, a chiral pair and the meso isomer.  All are colorless liquids.  Applications include precursors to various plastics and pesticides.
Compound: Phenazocine, (-)-
SMILES: Oc1cc2c(C[C@H]3N(CCc4ccccc4)CC[C@@]2([C@H]3C)C)cc1
InChIKey: ZQHYKVKNPWDQSL-KNXBSLHKSA-N
Synonyms: Phenazocine, (-)-, (-)-Phenazocine, (-)-alpha-Phenazocine, Phenazocine cis-(-)-form [MI], UNII-7UZW80C91Q, 7UZW80C91Q, 58640-87-2, DTXSID30110040, (-)-.ALPHA.-PHENAZOCINE, 2,6-Methano-3-benzazocin-8-ol, 1,2,3,4,5,6-hexahydro-6,11-dimethyl-3-(2-phenylethyl)-, (2R-(2alpha,6alpha,11R*))-, (1R,9R,13R)-1,13-dimethyl-10-(2-phenylethyl)-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol, 2,6-METHANO-3-BENZAZOCIN-8-OL, 1,2,3,4,5,6-HEXAHYDRO-6,11-DIMETHYL-3-(2-PHENYLETHYL)-, (2R-(2.ALPHA.,6.ALPHA.,11R*))-, (1R,9R,13R)-1,13-dimethyl-10-(2-phenylethyl)-10-azatricyclo(7.3.1.02,7)trideca-2(7),3,5-trien-4-ol, RefChem:172643, PHENAZOCINE CIS-(-)-FORM, DTXCID701349418, CHEMBL316632, PDSP2_001226, C11790, 58073-76-0, SCHEMBL21994211, (+/-)-.ALPHA.-PHENAZOCINE, DB13606, NS00114169, (2R,6R,11R)-6,11-Dimethyl-3-(2-phenylethyl)-1,2,3,4,5,6-hexahydro-2,6-methano-3-benzazocin-8-ol
Theoretical properties:
molecular_formula: C22H27NO
molecular_weight: 321.5 g/mol
exact_mass: 321.209264485 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 1
hydrogen_bond_acceptor_count: 2
rotatable_bond_count: 3
heavy_atom_count: 24
topological_polar_surface_area: 23.5 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
Descriptions:
pubchem: Phenazocine is a benzazocine.
chembl: Unnamed Compound is a small molecule listed in the ChEMBL database but has not progressed to an approved clinical phase.
wikipedia: Phenazocine (brand names Prinadol, Narphen) is an opioid analgesic drug, which is related to pentazocine and has a similar profile of effects.
Effects of phenazocine include analgesia and euphoria, also may include dysphoria and hallucinations at high doses, most likely due to action at κ-opioid and σ receptors.
Phenazocine appears to be a much stronger analgesic with fewer side effects than pentazocine, probably due to a more favorable μ/κ binding ratio.  Phenazocine is a much more potent analgesic than pentazocine and other drugs in the benzomorphan series, most probably due to the presence of an N-phenethyl substitution, which is known to boost μ-opioid activity in many classes of opioid analgesics.  Also, it does not cause spasm of the sphincter of Oddi, making it more suitable than morphine for the treatment of biliary or pancreatic pain.
Regarding the two enantiomers of phenazocine, (R)-phenazocine has twenty times the potency of morphine as an analgesic, while (S)-phenazocine has about four times the potency of morphine.
Compound: Pyrazolidine
SMILES: N1NCCC1
InChIKey: USPWKWBDZOARPV-UHFFFAOYSA-N
Synonyms: Pyrazolidine, 504-70-1, tetrahydropyrazole, 1,2-diazacyclopentane, UNII-Y0MA3161MR, Y0MA3161MR, CHEBI:33138, DTXSID30198444, RefChem:177461, DTXCID60120935, InChI=1/C3H8N2/c1-2-4-5-3-1/h4-5H,1-3H, SCHEMBL3627, SCHEMBL5595, SCHEMBL22580, SCHEMBL22706, SCHEMBL719234, SCHEMBL1162558, SCHEMBL1162686, SCHEMBL1666302, SCHEMBL5228611, SCHEMBL5334019, SCHEMBL6241108, USPWKWBDZOARPV-UHFFFAOYSA-N, AKOS022529442, SB37386, DA-18278, EN300-225337, Q411281
Theoretical properties:
molecular_formula: C3H8N2
molecular_weight: 72.11 g/mol
exact_mass: 72.068748264 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 2
hydrogen_bond_acceptor_count: 2
rotatable_bond_count: 0
heavy_atom_count: 5
topological_polar_surface_area: 24.1 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
Descriptions:
pubchem: Pyrazolidine is an azacycloalkane that is the 1,2-diaza derivative of cyclopentane. It is a saturated organic heteromonocyclic parent, an azacycloalkane and a member of pyrazolidines.
chebi: An azacycloalkane that is the 1,2-diaza derivative of cyclopentane
wikipedia: Pyrazolidine is a heterocyclic compound. It is a liquid that is stable in air, but it is hygroscopic.
Compound: PROPIRAM
SMILES: O=C(N(c1ncccc1)C(CN2CCCCC2)C)CC
InChIKey: ZBAFFZBKCMWUHM-UHFFFAOYSA-N
Synonyms: PROPIRAM, Propiramum, 15686-91-6, BAY-4503 FREE BASE, WT6247U6PX, IDS-NP-016(SECT.2), Propionamide, N-(1-methyl-2-piperidinoethyl)-N-2-pyridyl-, DTXSID1023522, N-(1-methyl-2-piperidinoethyl)-N-(2-pyridyl)propionamide, RefChem:869677, DTXCID703522, 239-775-7, Isopropiram, N-(1-Methyl-2-(1-piperidinyl)ethyl)-N-2-pyridinylpropanamide, 52373-67-8, DEA No. 9649, Propanamide, N-(1-methyl-2-(1-piperidinyl)ethyl)-N-2-pyridinyl-, Propanamide, N-[1-methyl-2-(1-piperidinyl)ethyl]-N-2-pyridinyl-, Propiram [INN:BAN], Propiramo, Propiramum [INN-Latin], Propiramo [INN-Spanish], EINECS 239-775-7, BRN 0485057, UNII-WT6247U6PX, (RS)-cis-N-(2-Piperidinopropyl)-N-2-pyridylpropionamide, PROPIRAM [INN], PROPIRAM [MI], Propionamide, N-(2-piperidinopropyl)-N-2-pyridyl-, (RS)-(Z)-, PROPIRAM [WHO-DD], SCHEMBL26193, (+/-)-PROPIRAM, CHEMBL2110985, N-(1-methyl-2-piperidinoethyl)-N-2-pyridylpropionamide, CHEBI:135140, N-[1-(Piperidin-1-yl)propan-2-yl]-N-(pyridin-2-yl)propanamide, Pregnane-11,20-dione, 3,21-dihydroxy-, (3-alpha,5-alpha)-, Propionamide, N-(1-methyl-2-(1-piperidinyl)ethyl)-N-2-pyridyl-, L004589, Q7250338, N-(1-Methyl-2-piperidinoethyl)-N-2-pyridinylpropionamide, N-(1-methyl-2-piperidin-1-ylethyl)-N-pyridin-2-ylpropanamide, (.+/-.)-N-(1-Methyl-2-piperidinoethyl)-N-2-pyridylpropionamide, Propionamide, N-(1-methyl-2-piperidinoethyl)-N-2-pyridyl-, (.+/-.)-
Theoretical properties:
molecular_formula: C16H25N3O
molecular_weight: 275.39 g/mol
exact_mass: 275.199762429 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 0
hydrogen_bond_acceptor_count: 3
rotatable_bond_count: 5
heavy_atom_count: 20
topological_polar_surface_area: 36.4 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
Descriptions:
pubchem: Propiram is a member of pyridines.
chembl: PROPIRAM is a small molecule listed in the ChEMBL database and has reached clinical trial phase 2.0.
wikipedia: Propiram (Algeril, Dirame, Bay 4503) is a partial μ-opioid receptor agonist and weak μ antagonist analgesic from the ampromide family of drugs related to other drugs such as phenampromide and diampromide. It was invented in 1963 in the United Kingdom by Bayer but was not widely marketed, although it saw some limited clinical use, especially in dentistry.  Propiram reached Phase III clinical trials in the United States and Canada.
Compound: Phenampromide, (R)-
SMILES: O=C(N(c1ccccc1)[C@@H](CN2CCCCC2)C)CC
InChIKey: DHTRHEVNFFZCNU-OAHLLOKOSA-N
Synonyms: Phenampromide, (R)-, Phenampromide, (-)-, GPX93563LD, UNII-GPX93563LD, 2101770-94-7, Propionanilide, N-(1-methyl-2-piperidinoethyl)-, (-)-, Propanamide, N-(1-methyl-2-(1-piperidinyl)ethyl)-N-phenyl-, (-)-, SCHEMBL907884, NS00041968
Theoretical properties:
molecular_formula: C17H26N2O
molecular_weight: 274.4 g/mol
exact_mass: 274.204513457 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 0
hydrogen_bond_acceptor_count: 2
rotatable_bond_count: 5
heavy_atom_count: 20
topological_polar_surface_area: 23.6 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
Descriptions:
wikipedia: Phenampromide is an opioid analgesic from the ampromide family of drugs, related to other drugs such as propiram and diampromide. It was invented in the 1960s by American Cyanamid Co.  Although never given a general release, it was research found that 60 mg of phenampromide is equivalent to about 50 mg of codeine. Tests on its two enantiomers showed that all of the analgesic effects were caused by the (S)-isomer. Introduction of a phenyl group to the 4-position of the piperidine-ring produces a drug 60-fold more potent than morphine. The most potent reported derivative is 4-hydroxy-4-phenyl phenapromide which displays analgesic activity some x150 greater than morphine. 

Phenampromide produces similar effects to fentanyl, including analgesia, sedation, dizziness and nausea.
Phenampromide is in Schedule I of the Controlled Substances Act 1970 of the United States as a narcotic with ACSCN 9638 with a zero aggregate manufacturing quota as of 2014.  The free base conversion ratio for salts includes 0.88 for the hydrochloride.  It is listed under the Single Convention for the Control of Narcotic Substances 1961 and is controlled in most countries in the same fashion as fentanyl.
Compound: Diampromide
SMILES: O=C(N(c1ccccc1)CC(N(CCc2ccccc2)C)C)CC
InChIKey: RXTHKWVSXOIHJS-UHFFFAOYSA-N
Synonyms: Diampromide, Diampromid, Diampromidum, Diampromida, Diampromidum [INN-Latin], Diampromida [INN-Spanish], Diampromide [INN:BAN:DCF], Acscn-9615, UNII-26G7YC77BU, BRN 2818206, 26G7YC77BU, IDS-ND-005, DIAMPROMIDE [MI], DIAMPROMIDE [INN], N-(2-(Methylphenethylamino)propyl)propionanilide, N-[2-(Methylphenethylamino)propyl]propionanilide, Propionanilide, N-(2-(methylphenethylamino)propyl)-, DTXSID70862177, Propanamide, N-(2-(methyl(2-phenylethyl)amino)propyl)-N-phenyl-, Diampromide (INN), N-{2-[Methyl(2-phenylethyl)amino]propyl}-N-phenylpropanamide, Propanamide, N-[2-[methyl(2-phenylethyl)amino]propyl]-N-phenyl-, Diampromidum (INN-Latin), Diampromida (INN-Spanish), Propionanilide, N-[2-(methylphenethylamino)propyl]-, N-(2-(Methyl(2-phenylethyl)amino)propyl)-N-phenylpropanamide, RefChem:132648, DTXCID60810980, Propanamide, N-(2-(methyl(2-phenylethyl)amino)propyl)-N-phenyl-(9CI), RXTHKWVSXOIHJS-UHFFFAOYSA-N, 552-25-0, DEA No. 9615, SCHEMBL24233, CHEMBL2106220, CHEBI:135386, DB01502, D12694, Q5271028, N-(2-[Methyl(2-phenylethyl)amino]propyl)-N-phenylpropanamide #
Theoretical properties:
molecular_formula: C21H28N2O
molecular_weight: 324.5 g/mol
exact_mass: 324.220163521 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 0
hydrogen_bond_acceptor_count: 2
rotatable_bond_count: 8
heavy_atom_count: 24
topological_polar_surface_area: 23.6 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
melting_point: < 25 °C
Descriptions:
pubchem: Diampromide is an anilide.
chembl: DIAMPROMIDE is a small molecule listed in the ChEMBL database and has reached clinical trial phase 2.0.
wikipedia: Diampromide is an opioid analgesic from the ampromide family of drugs, related to other drugs such as propiram and phenampromide. It was invented in the 1960s by American Cyanamid, and can be described as a ring-opened analogue of fentanyl.
Diampromide produces similar effects to other opioids, including analgesia, sedation, dizziness and nausea, and is around the same potency as morphine.
Diampromide is in Schedule I of the Controlled Substances Act 1970 of the United States as a Narcotic with ACSCN 9615 with a zero aggregate manufacturing quota as of 2014.  It is listed under the Single Convention for the Control of Narcotic Substances 1961 and is controlled in most countries in the same fashion as is morphine.