Molecule ID: 643

IUPAC Name: 6-(5-methyl-2-oxoimidazolidin-4-yl)hexanoic acid

Description: The molecule is a hexanoic acid having a 5-methyl-2-oxoimidazolidin-4-yl group at the 6-position. It has a role as an Escherichia coli metabolite. It is a monocarboxylic acid, a member of ureas and an imidazolidinone. It derives from a hexanoic acid. It is a conjugate acid of a dethiobiotin(1-) and a (4R,5S)-dethiobiotin(1-).

SMILES: CC1N=C(O)NC1CCCCCC(=O)O

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

InChI: InChI=1S/C10H18N2O3/c1-7-8(12-10(15)11-7)5-3-2-4-6-9(13)14/h7-8H,2-6H2,1H3,(H,13,14)(H2,11,12,15)

Molecular Properties:
- Polar Surface Area: 78.4 Ų
- LogP: 0.8