Molecule ID: 84290

IUPAC Name: 2-(octanoylamino)acetic acid

Description: The molecule is an N-acylglycine that has octanoyl as the acyl group. It has a role as a metabolite. It is a N-acylglycine and a fatty amide. It derives from an octanoic acid and a glycine. It is a conjugate acid of a N-octanoylglycinate.

SMILES: CCCCCCCC(O)=NCC(=O)O

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

InChI: InChI=1S/C10H19NO3/c1-2-3-4-5-6-7-9(12)11-8-10(13)14/h2-8H2,1H3,(H,11,12)(H,13,14)

Molecular Properties:
- Polar Surface Area: 66.4 Ų
- LogP: 2.1