2-[(5-chloro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid

C14H11ClN2O3 — CID 82881193

IUPAC2-[(5-chloro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid
SMILESCc1ccc(Cl)cc1C(=O)Nc1ncccc1C(=O)O
InChIInChI=1S/C14H11ClN2O3/c1-8-4-5-9(15)7-11(8)13(18)17-12-10(14(19)20)3-2-6-16-12/h2-7H,1H3,(H,19,20)(H,16,17,18)
InChIKeyFEORWDNRYITXIW-UHFFFAOYSA-N
MW290.71 g/mol
LogP2.99
Rot. Bonds3

About 2-[(5-chloro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid

2-[(5-chloro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid (PubChem CID 82881193) has the molecular formula C14H11ClN2O3 and a molecular weight of 290.71 g/mol. Its IUPAC name is 2-[(5-chloro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-[(5-chloro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid
PubChem CID82881193
Molecular FormulaC14H11ClN2O3
Molecular Weight290.71 g/mol
Exact Mass290.05
IUPAC Name2-[(5-chloro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid
SMILESCc1ccc(Cl)cc1C(=O)Nc1ncccc1C(=O)O
InChIInChI=1S/C14H11ClN2O3/c1-8-4-5-9(15)7-11(8)13(18)17-12-10(14(19)20)3-2-6-16-12/h2-7H,1H3,(H,19,20)(H,16,17,18)
InChIKeyFEORWDNRYITXIW-UHFFFAOYSA-N
XLogP2.99
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.71
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-methyl-5-methylsulfanylbenzoyl)amino]pyridine-3-carboxylic acid
CID 63652866
5-chloro-N-(3-chloropyrazin-2-yl)-2-methylbenzamide
CID 102989278
2-[(4-chlorobenzoyl)amino]pyridine-3-carboxylic acid
CID 63654258
2-[(2-chloropyridine-3-carbonyl)amino]pyridine-3-carboxylic acid
CID 114036719
2-[(3-fluoro-4-methylbenzoyl)amino]pyridine-3-carboxylic acid
CID 63653746
2,4-dichloro-N-(3-methyl-2-pyridinyl)benzamide
CID 836075
2-[(2,4-dichloro-5-fluorobenzoyl)amino]pyridine-3-carboxylic acid
CID 63653408
2-[(3-methyl-2-pyridinyl)carbamoyl]benzoic acid
CID 738391
2-[(2-chloro-5-hydroxybenzoyl)amino]pyridine-3-carboxylic acid
CID 106500292
2-[(4-chloro-2-methylphenyl)sulfonylamino]pyridine-3-carboxylic acid
CID 63653933
N-(5-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide
CID 110859088
5-[(5-chloro-2-methylbenzoyl)amino]-2-methylbenzoic acid
CID 82877012

Frequently Asked Questions

What is the IUPAC name of 2-[(5-chloro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid?
The IUPAC name of 2-[(5-chloro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid (CID 82881193) is 2-[(5-chloro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid.
What is the SMILES notation for 2-[(5-chloro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid?
The canonical SMILES for 2-[(5-chloro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid is Cc1ccc(Cl)cc1C(=O)Nc1ncccc1C(=O)O.
What is the InChIKey of 2-[(5-chloro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid?
The InChIKey is FEORWDNRYITXIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClN2O3/c1-8-4-5-9(15)7-11(8)13(18)17-12-10(14(19)20)3-2-6-16-12/h2-7H,1H3,(H,19,20)(H,16,17,18).
What are the key properties of 2-[(5-chloro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid?
2-[(5-chloro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid has a molecular weight of 290.71 g/mol, XLogP of 2.99, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-chloro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid is sourced from PubChem (CID 82881193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).