Compound: 3,4-Dimethoxyphenethylamine
SMILES: O(c1c(OC)ccc(c1)CCN)C
InChIKey: ANOUKFYBOAKOIR-UHFFFAOYSA-N
Synonyms: 3,4-Dimethoxyphenethylamine, 120-20-7, Homoveratrylamine, 3,4-Dimethoxyphenylethylamine, 2-(3,4-Dimethoxyphenyl)ethylamine, Benzeneethanamine, 3,4-dimethoxy-, Dimethoxydopamine, Dimethylmescaline, DMPEA, 3,4-Dimethoxybenzeneethanamine, Dopamine dimethyl ether, DIMPEA, O,O-Dimethyldopamine, 3,4-Di-O-methyldopamine, 3,4-Dimethoxydopamine, 2-(3,4-Dimethoxyphenyl)Ethan-1-Amine, 3,4-Dimethoxyphenylethylamine(base), 3,4-Dimethoxy-beta-phenylethylamine, beta-(3,4-Dimethyoxyphenyl)ethylamine, NSC 16948, 2-(3,4-Dimethoxy-phenyl)-ethylamine, PHENETHYLAMINE, 3,4-DIMETHOXY-, EINECS 204-376-9, IQF9T435OP, 3,4-Dimethoxyphenylethylamine (base), 3,4-Dimethoxy-.beta.-phenylethylamine, BRN 0474393, AI3-23876, CHEBI:136995, NSC-6328, NSC-16948, NSC-26152, DOPAMINE IMPURITY C, DTXSID8059506, EC 204-376-9, 4-13-00-02604 (Beilstein Handbook Reference), 2-(3,4-dimethoxyphenyl) ethylamine, DOPAMINE HYDROCHLORIDE IMPURITY C [EP IMPURITY], DOPAMINE HYDROCHLORIDE IMPURITY C (EP IMPURITY), O,ODimethyldopamine, 3,4Dimethoxydopamine, 3,4DiOmethyldopamine, HOMOVERATRILAMINE, RefChem:788471, 3,4dimethoxyphenethylamine, 3,4Dimethoxyphenylethylamine, 3,4Dimethoxybenzeneethanamine, Phenethylamine, 3,4dimethoxy, 3,4Dimethoxybetaphenylethylamine, Benzeneethanamine, 3,4dimethoxy, DTXCID6033530, 2(3,4Dimethoxyphenyl)ethylamine, beta(3,4Dimethoxyphenyl)ethylamine, 3,4Dimethoxyphenylethylamine (base), InChI=1/C10H15NO2/c1-12-9-4-3-8(5-6-11)7-10(9)13-2/h3-4,7H,5-6,11H2,1-2H, 2-(3,4-Dimethoxyphenyl)ethanamine, Dopamine EP Impurity C, 2-(3,4-dimethoxyphenyl)-ethylamine, MFCD00008188, 3,4-dimethoxy phenylethylamine, 3,4-Dimethoxypheneethylamine, 3,4-dimethyloxyphenylethylamine, 3,4-Dimethoxy-.beta.-phenethylamine, beta-(3,4-Dimethoxyphenyl)ethylamine, .beta.-(3,4-Dimethoxyphenyl)ethylamine, Phenethylamine,4-dimethoxy-, Benzeneethanamine,4-dimethoxy-, WLN: Z2R CO1 DO1, 3,4-Dimethoxy phenethylamine, SMR000112358, UNII-IQF9T435OP, homoveratryl amine, 3,4-DIMETHOXY-PHENETHYLAMINE, 2-(3,4-Dimethoxyphenyl)-1-aminoethane, Tetrabenazine Impurity N4, Epitope ID:119694, NCIOpen2_005995, Oprea1_397610, 3, 4-Dimethoxyphenethylamine, Dopamine Impurity C (3,4-Dimethoxyphenethylamine), MLS000515889, MLS001424180, CHEMBL26019, SCHEMBL210639, 3,4-di-methoxy-phenethylamine, 3,4-dimethyoxyphenylethylamine, 3,4-dimethoxy-phenylethylamine, 3,4-Dimethoxy-Benzenethanamine, orb1298183, SCHEMBL1148327, SCHEMBL7319619, 3, 4-Dimethoxybenzeneethanamine, b-3,4-dimethoxyphenylethylamine, 3,4-Dimethoxy-Benzeneethanamine, Phenethyl amine, 3,4-dimethoxy, SCHEMBL27420720, SCHEMBL28007523, SCHEMBL29351641, NSC6328, 2(3,4-dimethoxyphenyl)ethylamine, Benzenethanamine, 3,4-dimethoxy-, 3,4-Dimethoxy-beta-phenethylamine, b-(3,4-dimethoxyphenyl)ethylamine, HMS2052A09, HMS2269O22, HMS3394A09, 3,4-Dimethoxyphenethylamine, 97%, 3, 4-Dimethoxy-beta-phenethylamine, HY-Y0935, MBA69947, NSC16948, NSC26152, b-(3,4-dimethoxyphenyl)ethyl amine, 2-(3,4-dimethoxy-phenyl)ethylamine, BBL023006, EBC-03544, SBB008220, STK397473, 3, 4-Dimethoxy-beta-phenylethylamine, 3, 4-Dimethoxyphenylethylamine(base), 3,4-dimethoxy-beta-phenyl-ethylamine, [2-(3,4-dimethoxyphenyl)ethyl]amine, 2-(3,4-dimethoxy-phenyl)ethyl amine, 2-(3,4-Dimethoxyphenyl)ethanamine #, AKOS000104026, beta-(3,4-dimethoxyphenyl)-ethylamine, AC-8488, CCG-101095, CS-W023192, FH23862, FS-4041, NC00345, 2-(3',4'-dimethoxyphenyl)-ethylamine, beta-(3,4 -dimethoxyphenyl) ethylamine, NCGC00247022-01, DB-001827, DB-003355, D0678, NS00004795, ST45026146, EN300-20212, F008886, Q4634069, 2-(3,4-Dimethoxyphenyl)ethanamine (ACD/Name 4.0), 2-(3,4-Dimethoxyphenyl)ethylamine (ACD/Name 4.0), BRD-K59570838-003-01-9, F2190-0398, Z104477298
Theoretical properties:
molecular_formula: C10H15NO2
molecular_weight: 181.23 g/mol
exact_mass: 181.110278721 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 1
hydrogen_bond_acceptor_count: 3
rotatable_bond_count: 4
heavy_atom_count: 13
topological_polar_surface_area: 44.5 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
boiling_point: 163 - 165 °C
solubility: 24.8 [ug/mL] (The mean of the results at pH 7.4)
vapor_pressure: 0.00261 [mmHg]
Descriptions:
pubchem: 3,4-dimethoxyphenylethylamine is an aromatic ether that is the derivative of 2-phenylethylamine with methoxy substituents at the 3- and 4-positions. It is an alkaloid isolated from the Cactaceae family. It has a role as an allergen and a plant metabolite. It is an alkaloid, an aromatic ether and a phenylethylamine. It derives from a hydride of a 2-phenylethylamine.
chebi: An  aromatic ether that is the derivative of 2-phenylethylamine with methoxy substituents at the 3- and 4-positions. It is an alkaloid isolated from the <em>Cactaceae</em> family.
chembl: Unnamed Compound is a small molecule listed in the ChEMBL database but has not progressed to an approved clinical phase.
wikipedia: 3,4-Dimethoxyphenethylamine (DMPEA or 3,4-DMPEA), also known as homoveratrylamine, 3-desmethoxymescaline, or O,O-dimethyldopamine, is a chemical compound of the phenethylamine family. It is an analogue of the major human neurotransmitter dopamine where the 3- and 4-position hydroxy groups have been replaced with methoxy groups. It is also closely related to mescaline (3,4,5-trimethoxyphenethylamine; 3,4,5-TMPEA) and to 3,4-dimethoxyamphetamine (3,4-DMA).