Molecule ID: 71002

IUPAC Name: 2-benzamidopropanoic acid

Description: The molecule is an N-acylamino acid that is the N-benzoyl derivative of alanine. It has a role as a metabolite. It is an alanine derivative and a N-acyl-amino acid.

SMILES: CC(N=C(O)c1ccccc1)C(=O)O

SELFIES: [C][C][Branch1][=C][N][=C][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O]

InChI: InChI=1S/C10H11NO3/c1-7(10(13)14)11-9(12)8-5-3-2-4-6-8/h2-7H,1H3,(H,11,12)(H,13,14)

Molecular Properties:
- Polar Surface Area: 66.4 Ų
- LogP: 1.2