Molecule ID: 4362

IUPAC Name: 1-ethylpyrrole-2,5-dione

Description: The molecule is a member of the class of maleimides that is the N-ethyl derivative of maleimide. It has a role as an EC 2.1.1.122 [(S)-tetrahydroprotoberberine N-methyltransferase] inhibitor, an EC 2.7.1.1 (hexokinase) inhibitor, an EC 1.3.1.8 [acyl-CoA dehydrogenase (NADP(+))] inhibitor and an anticoronaviral agent. It derives from a maleimide.

SMILES: CCN1C(=O)C=CC1=O

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

InChI: InChI=1S/C6H7NO2/c1-2-7-5(8)3-4-6(7)9/h3-4H,2H2,1H3

Molecular Properties:
- Polar Surface Area: 37.4 Ų
- LogP: 0.9