Molecule ID: 6300471

IUPAC Name: (Z)-2-(4-methoxyphenyl)-3-(6-methylpyridin-2-yl)prop-2-enoic acid

Description: The molecule is a monocarboxylic acid that is acrylic acid with substituents 4-methoxyphenyl at position 2 and 6-methylpyridin-2-yl at position 3. It has a role as a metabolite. It is a monocarboxylic acid, a monomethoxybenzene and a member of pyridines. It derives from an acrylic acid.

SMILES: COc1ccc(/C(=C/c2cccc(C)n2)C(=O)O)cc1

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

InChI: InChI=1S/C16H15NO3/c1-11-4-3-5-13(17-11)10-15(16(18)19)12-6-8-14(20-2)9-7-12/h3-10H,1-2H3,(H,18,19)/b15-10-

Molecular Properties:
- Polar Surface Area: 59.4 Ų
- LogP: 2.8