Molecule ID: 25561

IUPAC Name: 2-acetamido-5-amino-5-oxopentanoic acid

Description: The molecule is a glutamine derivative with an acetyl group bound at the alpha-amino group. It has a role as a human urinary metabolite. It is a N-acetyl-amino acid and a N(2)-acylglutamine.

SMILES: CC(O)=NC(CCC(=N)O)C(=O)O

SELFIES: [C][C][Branch1][C][O][=N][C][Branch1][Branch2][C][C][C][=Branch1][C][=N][O][C][=Branch1][C][=O][O]

InChI: InChI=1S/C7H12N2O4/c1-4(10)9-5(7(12)13)2-3-6(8)11/h5H,2-3H2,1H3,(H2,8,11)(H,9,10)(H,12,13)

Molecular Properties:
- Polar Surface Area: 110.0 Ų
- LogP: -1.4