3-[(2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid

C12H14N2O4 — CID 66033110

IUPAC3-[(2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid
SMILESO=C(NC1CCC(C(=O)O)C1)c1ccc[nH]c1=O
InChIInChI=1S/C12H14N2O4/c15-10-9(2-1-5-13-10)11(16)14-8-4-3-7(6-8)12(17)18/h1-2,5,7-8H,3-4,6H2,(H,13,15)(H,14,16)(H,17,18)
InChIKeySBNQOGVXLROVEA-UHFFFAOYSA-N
MW250.25 g/mol
LogP0.36
Rot. Bonds3

About 3-[(2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid

3-[(2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid (PubChem CID 66033110) has the molecular formula C12H14N2O4 and a molecular weight of 250.25 g/mol. Its IUPAC name is 3-[(2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name3-[(2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid
PubChem CID66033110
Molecular FormulaC12H14N2O4
Molecular Weight250.25 g/mol
Exact Mass250.10
IUPAC Name3-[(2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid
SMILESO=C(NC1CCC(C(=O)O)C1)c1ccc[nH]c1=O
InChIInChI=1S/C12H14N2O4/c15-10-9(2-1-5-13-10)11(16)14-8-4-3-7(6-8)12(17)18/h1-2,5,7-8H,3-4,6H2,(H,13,15)(H,14,16)(H,17,18)
InChIKeySBNQOGVXLROVEA-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

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Related Compounds

4-[(2-oxo-1H-pyridine-3-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 21804993
4-[(1-Methyl-2-oxopyridine-3-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 21805076
2-[(2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 64812055
2-[3-(2-Oxo-1-pyridinyl)propanoylamino]cyclopentane-1-carboxylic acid
CID 64812674
(3S)-5-methyl-3-[[(2-oxo-1H-pyridine-3-carbonyl)amino]methyl]hexanoic acid
CID 65493282
5-methyl-3-[[(2-oxo-1H-pyridine-3-carbonyl)amino]methyl]hexanoic acid
CID 65523827
2-[[(2-oxo-1H-pyridine-3-carbonyl)amino]methyl]cyclopentane-1-carboxylic acid
CID 65897619
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-[(5-nitro-2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 66030533
3-[(2-hydroxy-6-oxo-1H-pyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 66031726

Frequently Asked Questions

What is the IUPAC name of 3-[(2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 3-[(2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid (CID 66033110) is 3-[(2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 3-[(2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 3-[(2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid is O=C(NC1CCC(C(=O)O)C1)c1ccc[nH]c1=O.
What is the InChIKey of 3-[(2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid?
The InChIKey is SBNQOGVXLROVEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O4/c15-10-9(2-1-5-13-10)11(16)14-8-4-3-7(6-8)12(17)18/h1-2,5,7-8H,3-4,6H2,(H,13,15)(H,14,16)(H,17,18).
What are the key properties of 3-[(2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid?
3-[(2-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-[(2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 66033110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).