Compound: ALVERINE
SMILES: N(CCCc1ccccc1)(CCCc2ccccc2)CC
InChIKey: ZPFXAOWNKLFJDN-UHFFFAOYSA-N
Synonyms: ALVERINE, 150-59-4, Phenopropamine, Phenpropamine, Profenil, Dipropylin, Dipropyline, Sestron, Di(phenylpropyl)ethylamine, N-Ethyl-3,3'-diphenyldipropylamine, Alverina, Sestron base, Bis(gamma-phenylpropyl)ethylamine, ethylbis(3-phenylpropyl)amine, Alverinum, N,N-Bis(3-phenylpropyl)ethylamine, N-Ethyl-N-(3-phenylpropyl)benzenepropanamine, Dipropylamine, N-ethyl-3,3'-diphenyl-, N-Ethyl-3-phenyl-N-(3-phenylpropyl)-1-propanamine, 46TIR1560O, DTXSID0048557, CHEBI:518413, RefChem:111762, DTXCID0028115, A03AX08, 205-763-5, Benzenepropanamine, N-ethyl-N-(3-phenylpropyl)-, N-ethyl-3-phenyl-N-(3-phenylpropyl)propan-1-amine, Alverinum [INN-Latin], Alverina [INN-Spanish], N-Ethyl-bis(3-phenylpropyl)amin, Alverine (INN), ALVERINE [INN], Alverine [INN:BAN], HSDB 3284, EINECS 205-763-5, Meteospasmyl, UNII-46TIR1560O, Spectrum_000028, ALVERINE [HSDB], Alverine citrate(USAN), ALVERINE [MI], Prestwick0_000174, Prestwick1_000174, Prestwick2_000174, Prestwick3_000174, ALVERINE [WHO-DD], SCHEMBL83067, BSPBio_000067, BSPBio_001800, KBioSS_000388, cid_21718, DivK1c_000312, SPBio_001988, BPBio1_000075, CHEMBL253371, BDBM37636, GTPL14185, HY-B0500A, KBio1_000312, KBio2_000388, KBio2_002956, KBio2_005524, NINDS_000312, HMS5087M07, Bis(.gamma.-phenylpropyl)ethylamine, EBC-26435, MFCD00075035, s5945, STL483709, AKOS016008801, DB01616, SB82386, IDI1_000312, QTL1_000007, NCGC00021122-01, NCGC00021122-02, NCGC00021122-03, NCGC00021122-04, NCGC00021122-05, NCGC00024034-03, NCGC00024034-04, AS-85789, citric acid;ethyl-bis(3-phenylpropyl)amine, SBI-0051275.P003, DB-081099, AB00053791, CS-0013316, NS00010383, D07440, G77842, AB00053791_15, AB00053791_16, EN300-18539591, Q4116162, BRD-K89055274-048-04-5, BRD-K89055274-048-14-4, BRD-K89055274-048-22-7, BRD-K89055274-048-23-5, N-Ethyl-3-phenyl-N-(3-phenylpropyl)-1-propanamine #, N-ethyl-3-phenyl-N-(3-phenylpropyl)-1-propanamine;2-hydroxypropane-1,2,3-tricarboxylic acid, N-ethyl-3-phenyl-N-(3-phenylpropyl)propan-1-amine;2-oxidanylpropane-1,2,3-tricarboxylic acid
Theoretical properties:
molecular_formula: C20H27N
molecular_weight: 281.4 g/mol
exact_mass: 281.214349865 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 0
hydrogen_bond_acceptor_count: 1
rotatable_bond_count: 9
heavy_atom_count: 21
topological_polar_surface_area: 3.2 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
physical_state: LIQUID
color: LIQUID
melting_point: < 25 °C
solubility: SIRUP; SOL IN WATER /HYDROCHLORIDE/
Descriptions:
pubchem: Alverine is a tertiary amine having one ethyl and two 3-phenylprop-1-yl groups attached to the nitrogen. An antispasmodic that acts directly on intestinal and uterine smooth muscle, it is used (particularly as the citrate salt) in the treatment of irritable bowel syndrome. It has a role as an antispasmodic drug. It is a conjugate base of an alverine(1+).
chebi: A tertiary amine having one ethyl and two 3-phenylprop-1-yl groups attached to the nitrogen. An antispasmodic that acts directly on intestinal and uterine smooth muscle, it is used (particularly as the citrate salt) in the treatment of irritable bowel syndrome.
chembl: ALVERINE is a small molecule listed in the ChEMBL database and has reached clinical trial phase 2.0.
wikipedia: Alverine is a drug used for functional gastrointestinal disorders. Alverine is a smooth muscle relaxant. Smooth muscle is a type of muscle that is not under voluntary control; it is the muscle present in places such as the gut and uterus.