2-chloro-6-[(1-methyl-2-oxopyridine-4-carbonyl)amino]benzoic acid

C14H11ClN2O4 — CID 63722587

IUPAC2-chloro-6-[(1-methyl-2-oxopyridine-4-carbonyl)amino]benzoic acid
SMILESCn1ccc(C(=O)Nc2cccc(Cl)c2C(=O)O)cc1=O
InChIInChI=1S/C14H11ClN2O4/c1-17-6-5-8(7-11(17)18)13(19)16-10-4-2-3-9(15)12(10)14(20)21/h2-7H,1H3,(H,16,19)(H,20,21)
InChIKeyFCHRIRLCFVHQHN-UHFFFAOYSA-N
MW306.71 g/mol
LogP1.99
Rot. Bonds3

About 2-chloro-6-[(1-methyl-2-oxopyridine-4-carbonyl)amino]benzoic acid

2-chloro-6-[(1-methyl-2-oxopyridine-4-carbonyl)amino]benzoic acid (PubChem CID 63722587) has the molecular formula C14H11ClN2O4 and a molecular weight of 306.71 g/mol. Its IUPAC name is 2-chloro-6-[(1-methyl-2-oxopyridine-4-carbonyl)amino]benzoic acid.

Molecular Properties

Compound Name2-chloro-6-[(1-methyl-2-oxopyridine-4-carbonyl)amino]benzoic acid
PubChem CID63722587
Molecular FormulaC14H11ClN2O4
Molecular Weight306.71 g/mol
Exact Mass306.04
IUPAC Name2-chloro-6-[(1-methyl-2-oxopyridine-4-carbonyl)amino]benzoic acid
SMILESCn1ccc(C(=O)Nc2cccc(Cl)c2C(=O)O)cc1=O
InChIInChI=1S/C14H11ClN2O4/c1-17-6-5-8(7-11(17)18)13(19)16-10-4-2-3-9(15)12(10)14(20)21/h2-7H,1H3,(H,16,19)(H,20,21)
InChIKeyFCHRIRLCFVHQHN-UHFFFAOYSA-N
XLogP1.99
TPSA88.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.71
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-6-[(3-methylbenzoyl)amino]benzoic acid
CID 63723600
2-chloro-6-[(3,5-dichlorobenzoyl)amino]benzoic acid
CID 63724110
N-(3,5-dichloro-2-hydroxyphenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 103891192
2-[(3-amino-4-methylbenzoyl)amino]-6-chlorobenzoic acid
CID 63723613
N-(2-bromo-4-chlorophenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 103774923
N-(2-chloro-4-cyanophenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 103799723
2-chloro-6-[(4-methoxybenzoyl)amino]benzoic acid
CID 63722745
2-chloro-6-[(5-iodothiophene-3-carbonyl)amino]benzoic acid
CID 79685074
2-chloro-6-[(2,5-dimethylpyrazole-3-carbonyl)amino]benzoic acid
CID 66128180
1-methyl-2-oxo-N-(2-propylphenyl)pyridine-4-carboxamide
CID 31870618
N-(2-bromo-3-nitrophenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 86816899
3-methyl-5-[(1-methyl-2-oxopyridine-4-carbonyl)amino]-1,2-thiazole-4-carboxylic acid
CID 60869010

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-[(1-methyl-2-oxopyridine-4-carbonyl)amino]benzoic acid?
The IUPAC name of 2-chloro-6-[(1-methyl-2-oxopyridine-4-carbonyl)amino]benzoic acid (CID 63722587) is 2-chloro-6-[(1-methyl-2-oxopyridine-4-carbonyl)amino]benzoic acid.
What is the SMILES notation for 2-chloro-6-[(1-methyl-2-oxopyridine-4-carbonyl)amino]benzoic acid?
The canonical SMILES for 2-chloro-6-[(1-methyl-2-oxopyridine-4-carbonyl)amino]benzoic acid is Cn1ccc(C(=O)Nc2cccc(Cl)c2C(=O)O)cc1=O.
What is the InChIKey of 2-chloro-6-[(1-methyl-2-oxopyridine-4-carbonyl)amino]benzoic acid?
The InChIKey is FCHRIRLCFVHQHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClN2O4/c1-17-6-5-8(7-11(17)18)13(19)16-10-4-2-3-9(15)12(10)14(20)21/h2-7H,1H3,(H,16,19)(H,20,21).
What are the key properties of 2-chloro-6-[(1-methyl-2-oxopyridine-4-carbonyl)amino]benzoic acid?
2-chloro-6-[(1-methyl-2-oxopyridine-4-carbonyl)amino]benzoic acid has a molecular weight of 306.71 g/mol, XLogP of 1.99, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-[(1-methyl-2-oxopyridine-4-carbonyl)amino]benzoic acid is sourced from PubChem (CID 63722587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).