Molecule ID: 56927720

IUPAC Name: (2S)-N-butyl-2-[(2-thiophen-2-ylacetyl)amino]propanamide

Description: The molecule is an L-alanine derivative obtained by formal condensation between N-butyl-L-alaninamide and 2-thienylacetic acid. It is a member of thiophenes, a L-alanine derivative and a secondary carboxamide.

SMILES: CCCCN=C(O)[C@H](C)N=C(O)Cc1cccs1

SELFIES: [C][C][C][C][N][=C][Branch1][C][O][C@H1][Branch1][C][C][N][=C][Branch1][C][O][C][C][=C][C][=C][S][Ring1][Branch1]

InChI: InChI=1S/C13H20N2O2S/c1-3-4-7-14-13(17)10(2)15-12(16)9-11-6-5-8-18-11/h5-6,8,10H,3-4,7,9H2,1-2H3,(H,14,17)(H,15,16)/t10-/m0/s1

Molecular Properties:
- Polar Surface Area: 86.4 Ų
- LogP: 1.8