Molecule ID: 768471

IUPAC Name: (E)-N-[2-(4-methoxyphenyl)ethyl]-3-phenylprop-2-enamide

Description: The molecule is a member of the class of cinnamamides that is trans-cinnamamide substituted by a 2-(4-methoxyphenyl)ethyl group at the nitrogen atom. It has been isolated from Pisonia aculeata. It has a role as a metabolite and a plant metabolite. It is a member of cinnamamides, a monomethoxybenzene and a secondary carboxamide. It derives from a trans-cinnamamide.

SMILES: COc1ccc(CCN=C(O)/C=C/c2ccccc2)cc1

SELFIES: [C][O][C][=C][C][=C][Branch2][Ring1][C][C][C][N][=C][Branch1][C][O][/C][=C][/C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][Ring1]

InChI: InChI=1S/C18H19NO2/c1-21-17-10-7-16(8-11-17)13-14-19-18(20)12-9-15-5-3-2-4-6-15/h2-12H,13-14H2,1H3,(H,19,20)/b12-9+

Molecular Properties:
- Polar Surface Area: 38.3 Ų
- LogP: 3.4