2-hydroxy-5-[(5-oxopyrrolidine-3-carbonyl)amino]benzoic acid

C12H12N2O5 — CID 83192489

IUPAC2-hydroxy-5-[(5-oxopyrrolidine-3-carbonyl)amino]benzoic acid
SMILESO=C1CC(C(=O)Nc2ccc(O)c(C(=O)O)c2)CN1
InChIInChI=1S/C12H12N2O5/c15-9-2-1-7(4-8(9)12(18)19)14-11(17)6-3-10(16)13-5-6/h1-2,4,6,15H,3,5H2,(H,13,16)(H,14,17)(H,18,19)
InChIKeyAOJURQLMCDDVFH-UHFFFAOYSA-N
MW264.24 g/mol
LogP0.17
Rot. Bonds3

About 2-hydroxy-5-[(5-oxopyrrolidine-3-carbonyl)amino]benzoic acid

2-hydroxy-5-[(5-oxopyrrolidine-3-carbonyl)amino]benzoic acid (PubChem CID 83192489) has the molecular formula C12H12N2O5 and a molecular weight of 264.24 g/mol. Its IUPAC name is 2-hydroxy-5-[(5-oxopyrrolidine-3-carbonyl)amino]benzoic acid.

Molecular Properties

Compound Name2-hydroxy-5-[(5-oxopyrrolidine-3-carbonyl)amino]benzoic acid
PubChem CID83192489
Molecular FormulaC12H12N2O5
Molecular Weight264.24 g/mol
Exact Mass264.07
IUPAC Name2-hydroxy-5-[(5-oxopyrrolidine-3-carbonyl)amino]benzoic acid
SMILESO=C1CC(C(=O)Nc2ccc(O)c(C(=O)O)c2)CN1
InChIInChI=1S/C12H12N2O5/c15-9-2-1-7(4-8(9)12(18)19)14-11(17)6-3-10(16)13-5-6/h1-2,4,6,15H,3,5H2,(H,13,16)(H,14,17)(H,18,19)
InChIKeyAOJURQLMCDDVFH-UHFFFAOYSA-N
XLogP0.17
TPSA115.73 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.24
LogP ≤ 50.17
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

Analyze 2-hydroxy-5-[(5-oxopyrrolidine-3-carbonyl)amino]benzoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-hydroxy-3-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 115338810
4-[(5-oxopyrrolidine-3-carbonyl)amino]benzoic acid
CID 82889171
N-[4-(cyclopropanecarbonylamino)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 78982525
N-[4-chloro-3-(methylcarbamoyl)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 78981588
5-oxo-N-(3-phenylphenyl)pyrrolidine-3-carboxamide
CID 136542533
N-(4-aminophenyl)-5-oxopyrrolidine-3-carboxamide
CID 81470239
5-[(1-acetylpiperidine-4-carbonyl)amino]-2-hydroxybenzoic acid
CID 108804438
5-oxo-N-(1,2,3,4-tetrahydroquinolin-7-yl)pyrrolidine-3-carboxamide
CID 81485613
N-(4-methyl-3-sulfamoylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 78983436
5-oxo-N-(4-sulfamoylphenyl)pyrrolidine-3-carboxamide
CID 78982828
2-hydroxy-5-[(5-methyloxolane-3-carbonyl)amino]benzoic acid
CID 114824292
5-bromo-2-[(5-oxopyrrolidine-3-carbonyl)amino]benzoic acid
CID 83191690

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-5-[(5-oxopyrrolidine-3-carbonyl)amino]benzoic acid?
The IUPAC name of 2-hydroxy-5-[(5-oxopyrrolidine-3-carbonyl)amino]benzoic acid (CID 83192489) is 2-hydroxy-5-[(5-oxopyrrolidine-3-carbonyl)amino]benzoic acid.
What is the SMILES notation for 2-hydroxy-5-[(5-oxopyrrolidine-3-carbonyl)amino]benzoic acid?
The canonical SMILES for 2-hydroxy-5-[(5-oxopyrrolidine-3-carbonyl)amino]benzoic acid is O=C1CC(C(=O)Nc2ccc(O)c(C(=O)O)c2)CN1.
What is the InChIKey of 2-hydroxy-5-[(5-oxopyrrolidine-3-carbonyl)amino]benzoic acid?
The InChIKey is AOJURQLMCDDVFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O5/c15-9-2-1-7(4-8(9)12(18)19)14-11(17)6-3-10(16)13-5-6/h1-2,4,6,15H,3,5H2,(H,13,16)(H,14,17)(H,18,19).
What are the key properties of 2-hydroxy-5-[(5-oxopyrrolidine-3-carbonyl)amino]benzoic acid?
2-hydroxy-5-[(5-oxopyrrolidine-3-carbonyl)amino]benzoic acid has a molecular weight of 264.24 g/mol, XLogP of 0.17, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-5-[(5-oxopyrrolidine-3-carbonyl)amino]benzoic acid is sourced from PubChem (CID 83192489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).