6-[(4-fluoro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid

C14H11FN2O3 — CID 22099585

IUPAC6-[(4-fluoro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid
SMILESCc1cc(F)ccc1C(=O)Nc1ccc(C(=O)O)cn1
InChIInChI=1S/C14H11FN2O3/c1-8-6-10(15)3-4-11(8)13(18)17-12-5-2-9(7-16-12)14(19)20/h2-7H,1H3,(H,19,20)(H,16,17,18)
InChIKeyKYZPLBTZEQGGBI-UHFFFAOYSA-N
MW274.25 g/mol
LogP2.48
Rot. Bonds3

About 6-[(4-fluoro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid

6-[(4-fluoro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid (PubChem CID 22099585) has the molecular formula C14H11FN2O3 and a molecular weight of 274.25 g/mol. Its IUPAC name is 6-[(4-fluoro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-[(4-fluoro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid
PubChem CID22099585
Molecular FormulaC14H11FN2O3
Molecular Weight274.25 g/mol
Exact Mass274.08
IUPAC Name6-[(4-fluoro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid
SMILESCc1cc(F)ccc1C(=O)Nc1ccc(C(=O)O)cn1
InChIInChI=1S/C14H11FN2O3/c1-8-6-10(15)3-4-11(8)13(18)17-12-5-2-9(7-16-12)14(19)20/h2-7H,1H3,(H,19,20)(H,16,17,18)
InChIKeyKYZPLBTZEQGGBI-UHFFFAOYSA-N
XLogP2.48
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.25
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 6-[(4-fluoro-2-methylbenzoyl)amino]pyridine-3-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

Frequently Asked Questions

What is the IUPAC name of 6-[(4-fluoro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid?
The IUPAC name of 6-[(4-fluoro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid (CID 22099585) is 6-[(4-fluoro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid.
What is the SMILES notation for 6-[(4-fluoro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid?
The canonical SMILES for 6-[(4-fluoro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid is Cc1cc(F)ccc1C(=O)Nc1ccc(C(=O)O)cn1.
What is the InChIKey of 6-[(4-fluoro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid?
The InChIKey is KYZPLBTZEQGGBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FN2O3/c1-8-6-10(15)3-4-11(8)13(18)17-12-5-2-9(7-16-12)14(19)20/h2-7H,1H3,(H,19,20)(H,16,17,18).
What are the key properties of 6-[(4-fluoro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid?
6-[(4-fluoro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid has a molecular weight of 274.25 g/mol, XLogP of 2.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4-fluoro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid is sourced from PubChem (CID 22099585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).