3-[(6-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid

C12H14N2O4 — CID 66032498

IUPAC3-[(6-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid
SMILESO=C(NC1CCC(C(=O)O)C1)c1ccc(=O)[nH]c1
InChIInChI=1S/C12H14N2O4/c15-10-4-2-8(6-13-10)11(16)14-9-3-1-7(5-9)12(17)18/h2,4,6-7,9H,1,3,5H2,(H,13,15)(H,14,16)(H,17,18)
InChIKeyWYRKVMRVLZPGMB-UHFFFAOYSA-N
MW250.25 g/mol
LogP0.36
Rot. Bonds3

About 3-[(6-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid

3-[(6-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid (PubChem CID 66032498) has the molecular formula C12H14N2O4 and a molecular weight of 250.25 g/mol. Its IUPAC name is 3-[(6-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name3-[(6-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid
PubChem CID66032498
Molecular FormulaC12H14N2O4
Molecular Weight250.25 g/mol
Exact Mass250.10
IUPAC Name3-[(6-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid
SMILESO=C(NC1CCC(C(=O)O)C1)c1ccc(=O)[nH]c1
InChIInChI=1S/C12H14N2O4/c15-10-4-2-8(6-13-10)11(16)14-9-3-1-7(5-9)12(17)18/h2,4,6-7,9H,1,3,5H2,(H,13,15)(H,14,16)(H,17,18)
InChIKeyWYRKVMRVLZPGMB-UHFFFAOYSA-N
XLogP0.36
TPSA99.26 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.25
LogP ≤ 50.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-[(6-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic 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

4-[(6-oxo-1H-pyridine-3-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 60808216
2-[(6-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 64813058
5-methyl-3-[[(6-oxo-1H-pyridine-3-carbonyl)amino]methyl]hexanoic acid
CID 65492676
(3S)-5-methyl-3-[[(6-oxo-1H-pyridine-3-carbonyl)amino]methyl]hexanoic acid
CID 65493682
2-[[(6-oxo-1H-pyridine-3-carbonyl)amino]methyl]cyclopentane-1-carboxylic acid
CID 65897219
2-[1-(6-oxo-1H-pyridine-3-carbonyl)pyrrolidin-3-yl]acetic acid
CID 65944634
3-[(1-Methyl-2-oxopyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 66030153
3-[(4,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 66030310
3-[[2-(5-Bromo-2-oxo-1-pyridinyl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 66030349
3-[(6-Oxopyran-3-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 66030915
3-[(2-hydroxy-6-oxo-1H-pyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 66031726
3-[[(2E,4E)-hexa-2,4-dienoyl]amino]cyclopentane-1-carboxylic acid
CID 66032320

Frequently Asked Questions

What is the IUPAC name of 3-[(6-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 3-[(6-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid (CID 66032498) is 3-[(6-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 3-[(6-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 3-[(6-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid is O=C(NC1CCC(C(=O)O)C1)c1ccc(=O)[nH]c1.
What is the InChIKey of 3-[(6-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid?
The InChIKey is WYRKVMRVLZPGMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O4/c15-10-4-2-8(6-13-10)11(16)14-9-3-1-7(5-9)12(17)18/h2,4,6-7,9H,1,3,5H2,(H,13,15)(H,14,16)(H,17,18).
What are the key properties of 3-[(6-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid?
3-[(6-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid has a molecular weight of 250.25 g/mol, XLogP of 0.36, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 66032498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).