2-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid

C13H16N2O4 — CID 64814321

IUPAC2-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid
SMILESCn1ccc(C(=O)NC2CCCC2C(=O)O)cc1=O
InChIInChI=1S/C13H16N2O4/c1-15-6-5-8(7-11(15)16)12(17)14-10-4-2-3-9(10)13(18)19/h5-7,9-10H,2-4H2,1H3,(H,14,17)(H,18,19)
InChIKeyFONUQVXBJADDNJ-UHFFFAOYSA-N
MW264.28 g/mol
LogP0.37
Rot. Bonds3

About 2-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid

2-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid (PubChem CID 64814321) has the molecular formula C13H16N2O4 and a molecular weight of 264.28 g/mol. Its IUPAC name is 2-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name2-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid
PubChem CID64814321
Molecular FormulaC13H16N2O4
Molecular Weight264.28 g/mol
Exact Mass264.11
IUPAC Name2-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid
SMILESCn1ccc(C(=O)NC2CCCC2C(=O)O)cc1=O
InChIInChI=1S/C13H16N2O4/c1-15-6-5-8(7-11(15)16)12(17)14-10-4-2-3-9(10)13(18)19/h5-7,9-10H,2-4H2,1H3,(H,14,17)(H,18,19)
InChIKeyFONUQVXBJADDNJ-UHFFFAOYSA-N
XLogP0.37
TPSA88.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid with MolForge

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Related Compounds

2-[(1-Butyl-5,6-dimethyl-2-oxopyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 69475721
6-[3-(3-Methyl-2-oxo-1-pyridinyl)propanoylamino]hexanoic acid
CID 39150888
6-[3-(4-Methyl-2-oxo-1-pyridinyl)propanoylamino]hexanoic acid
CID 39150891
1-[(1-Methyl-2-oxopyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 43350999
6-[(1-Methyl-2-oxopyridine-4-carbonyl)amino]hexanoic acid
CID 43352952
2-[(1-Methyl-2-oxopyridine-4-carbonyl)amino]hexanoic acid
CID 43469797
2-[1-(1-Methyl-2-oxopyridine-4-carbonyl)pyrrolidin-2-yl]acetic acid
CID 61372241
3-[(1-Methyl-2-oxopyridine-4-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 63042033
5-methyl-4-[2-[(2-oxo-1H-pyridine-3-carbonyl)amino]ethyl]hexanoic acid
CID 64345141
4-Ethyl-6-[(1-methyl-2-oxopyridine-4-carbonyl)amino]hexanoic acid
CID 64349211
4-ethyl-6-[(2-hydroxy-6-oxo-1H-pyridine-4-carbonyl)amino]hexanoic acid
CID 64349620
4-ethyl-6-[(6-oxo-1H-pyridine-3-carbonyl)amino]hexanoic acid
CID 64350598

Frequently Asked Questions

What is the IUPAC name of 2-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 2-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid (CID 64814321) is 2-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 2-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 2-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid is Cn1ccc(C(=O)NC2CCCC2C(=O)O)cc1=O.
What is the InChIKey of 2-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid?
The InChIKey is FONUQVXBJADDNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O4/c1-15-6-5-8(7-11(15)16)12(17)14-10-4-2-3-9(10)13(18)19/h5-7,9-10H,2-4H2,1H3,(H,14,17)(H,18,19).
What are the key properties of 2-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid?
2-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid has a molecular weight of 264.28 g/mol, XLogP of 0.37, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 64814321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).