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

C13H9FN2O4 — CID 107674901

IUPAC2-[(2-fluoro-4-hydroxybenzoyl)amino]pyridine-3-carboxylic acid
SMILESO=C(Nc1ncccc1C(=O)O)c1ccc(O)cc1F
InChIInChI=1S/C13H9FN2O4/c14-10-6-7(17)3-4-8(10)12(18)16-11-9(13(19)20)2-1-5-15-11/h1-6,17H,(H,19,20)(H,15,16,18)
InChIKeyFHYZOLAXDOBAFW-UHFFFAOYSA-N
MW276.22 g/mol
LogP1.88
Rot. Bonds3

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

2-[(2-fluoro-4-hydroxybenzoyl)amino]pyridine-3-carboxylic acid (PubChem CID 107674901) has the molecular formula C13H9FN2O4 and a molecular weight of 276.22 g/mol. Its IUPAC name is 2-[(2-fluoro-4-hydroxybenzoyl)amino]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-[(2-fluoro-4-hydroxybenzoyl)amino]pyridine-3-carboxylic acid
PubChem CID107674901
Molecular FormulaC13H9FN2O4
Molecular Weight276.22 g/mol
Exact Mass276.05
IUPAC Name2-[(2-fluoro-4-hydroxybenzoyl)amino]pyridine-3-carboxylic acid
SMILESO=C(Nc1ncccc1C(=O)O)c1ccc(O)cc1F
InChIInChI=1S/C13H9FN2O4/c14-10-6-7(17)3-4-8(10)12(18)16-11-9(13(19)20)2-1-5-15-11/h1-6,17H,(H,19,20)(H,15,16,18)
InChIKeyFHYZOLAXDOBAFW-UHFFFAOYSA-N
XLogP1.88
TPSA99.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.22
LogP ≤ 51.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2-chloro-5-hydroxybenzoyl)amino]pyridine-3-carboxylic acid
CID 106500292
2-[(2,4-dichloro-5-fluorobenzoyl)amino]pyridine-3-carboxylic acid
CID 63653408
3-[(2-fluoro-4-hydroxybenzoyl)amino]-2-hydroxybenzoic acid
CID 107675143
4-[(2-fluoro-4-hydroxybenzoyl)amino]pyridine-2-carboxylic acid
CID 107674896
2-[(2-chloropyridine-3-carbonyl)amino]pyridine-3-carboxylic acid
CID 114036719
2-[(4-bromo-3-fluorobenzoyl)amino]pyridine-3-carboxylic acid
CID 63653566
2-[(3-fluoro-4-methylbenzoyl)amino]pyridine-3-carboxylic acid
CID 63653746
2-[(3-bromo-4-fluorobenzoyl)amino]pyridine-3-carboxylic acid
CID 107949182
5-fluoro-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid
CID 107674704
2-(2,3,5,6-tetrafluoroanilino)pyridine-3-carboxylic acid
CID 107645096
2-[(5-chloro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid
CID 82881193
4-chloro-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid
CID 107674641

Frequently Asked Questions

What is the IUPAC name of 2-[(2-fluoro-4-hydroxybenzoyl)amino]pyridine-3-carboxylic acid?
The IUPAC name of 2-[(2-fluoro-4-hydroxybenzoyl)amino]pyridine-3-carboxylic acid (CID 107674901) is 2-[(2-fluoro-4-hydroxybenzoyl)amino]pyridine-3-carboxylic acid.
What is the SMILES notation for 2-[(2-fluoro-4-hydroxybenzoyl)amino]pyridine-3-carboxylic acid?
The canonical SMILES for 2-[(2-fluoro-4-hydroxybenzoyl)amino]pyridine-3-carboxylic acid is O=C(Nc1ncccc1C(=O)O)c1ccc(O)cc1F.
What is the InChIKey of 2-[(2-fluoro-4-hydroxybenzoyl)amino]pyridine-3-carboxylic acid?
The InChIKey is FHYZOLAXDOBAFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9FN2O4/c14-10-6-7(17)3-4-8(10)12(18)16-11-9(13(19)20)2-1-5-15-11/h1-6,17H,(H,19,20)(H,15,16,18).
What are the key properties of 2-[(2-fluoro-4-hydroxybenzoyl)amino]pyridine-3-carboxylic acid?
2-[(2-fluoro-4-hydroxybenzoyl)amino]pyridine-3-carboxylic acid has a molecular weight of 276.22 g/mol, XLogP of 1.88, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-fluoro-4-hydroxybenzoyl)amino]pyridine-3-carboxylic acid is sourced from PubChem (CID 107674901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).