Molecule ID: 119133

IUPAC Name: 3-oxo-N-(2-oxooxolan-3-yl)hexanamide

Description: The molecule is a N-acyl homoserine lactone that is the monocarboxylic acid amide resulting from the formal condensation of the carboxy group of 3-oxohexanoic acid with the amino group of homoserine lactone. It is a N-acyl homoserine lactone and a secondary carboxamide. It derives from a 3-oxohexanoic acid.

SMILES: CCCC(=O)CC(O)=NC1CCOC1=O

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

InChI: InChI=1S/C10H15NO4/c1-2-3-7(12)6-9(13)11-8-4-5-15-10(8)14/h8H,2-6H2,1H3,(H,11,13)

Molecular Properties:
- Polar Surface Area: 72.5 Ų
- LogP: 0.9