6-[(5-fluoro-2-hydroxybenzoyl)amino]pyridine-3-carboxylic acid

C13H9FN2O4 — CID 115298481

IUPAC6-[(5-fluoro-2-hydroxybenzoyl)amino]pyridine-3-carboxylic acid
SMILESO=C(O)c1ccc(NC(=O)c2cc(F)ccc2O)nc1
InChIInChI=1S/C13H9FN2O4/c14-8-2-3-10(17)9(5-8)12(18)16-11-4-1-7(6-15-11)13(19)20/h1-6,17H,(H,19,20)(H,15,16,18)
InChIKeyHCTFJKBAEQGBSJ-UHFFFAOYSA-N
MW276.22 g/mol
LogP1.88
Rot. Bonds3

About 6-[(5-fluoro-2-hydroxybenzoyl)amino]pyridine-3-carboxylic acid

6-[(5-fluoro-2-hydroxybenzoyl)amino]pyridine-3-carboxylic acid (PubChem CID 115298481) has the molecular formula C13H9FN2O4 and a molecular weight of 276.22 g/mol. Its IUPAC name is 6-[(5-fluoro-2-hydroxybenzoyl)amino]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-[(5-fluoro-2-hydroxybenzoyl)amino]pyridine-3-carboxylic acid
PubChem CID115298481
Molecular FormulaC13H9FN2O4
Molecular Weight276.22 g/mol
Exact Mass276.05
IUPAC Name6-[(5-fluoro-2-hydroxybenzoyl)amino]pyridine-3-carboxylic acid
SMILESO=C(O)c1ccc(NC(=O)c2cc(F)ccc2O)nc1
InChIInChI=1S/C13H9FN2O4/c14-8-2-3-10(17)9(5-8)12(18)16-11-4-1-7(6-15-11)13(19)20/h1-6,17H,(H,19,20)(H,15,16,18)
InChIKeyHCTFJKBAEQGBSJ-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

6-[(2,5-difluorobenzoyl)amino]pyridine-3-carboxylic acid
CID 61317560
6-[(2,4-difluorobenzoyl)amino]pyridine-3-carboxylic acid
CID 22099949
6-[[4-fluoro-2-(trifluoromethyl)benzoyl]amino]pyridine-3-carboxylic acid
CID 22099714
6-[(2-hydroxybenzoyl)amino]pyridine-3-carboxylic acid
CID 61317349
6-[(3-fluorobenzoyl)amino]pyridine-3-carboxylic acid
CID 61318981
5-fluoro-2-hydroxy-N-(5-nitro-2-pyridinyl)benzamide
CID 71403106
6-[(5-fluoropyridine-3-carbonyl)amino]pyridine-3-carboxylic acid
CID 113452818
6-[(2-hydroxy-4-methylbenzoyl)amino]pyridine-3-carboxylic acid
CID 61317963
5-fluoro-2-[(5-fluoro-2-hydroxybenzoyl)amino]benzoic acid
CID 115298431
N-(5-fluoro-2-pyridinyl)-3-hydroxy-4-methylbenzamide
CID 65479688
6-[(2-hydroxy-4-methoxybenzoyl)amino]pyridine-3-carboxylic acid
CID 61317558
5-fluoro-2-hydroxy-N-(1,2-oxazol-3-yl)benzamide
CID 115299087

Frequently Asked Questions

What is the IUPAC name of 6-[(5-fluoro-2-hydroxybenzoyl)amino]pyridine-3-carboxylic acid?
The IUPAC name of 6-[(5-fluoro-2-hydroxybenzoyl)amino]pyridine-3-carboxylic acid (CID 115298481) is 6-[(5-fluoro-2-hydroxybenzoyl)amino]pyridine-3-carboxylic acid.
What is the SMILES notation for 6-[(5-fluoro-2-hydroxybenzoyl)amino]pyridine-3-carboxylic acid?
The canonical SMILES for 6-[(5-fluoro-2-hydroxybenzoyl)amino]pyridine-3-carboxylic acid is O=C(O)c1ccc(NC(=O)c2cc(F)ccc2O)nc1.
What is the InChIKey of 6-[(5-fluoro-2-hydroxybenzoyl)amino]pyridine-3-carboxylic acid?
The InChIKey is HCTFJKBAEQGBSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9FN2O4/c14-8-2-3-10(17)9(5-8)12(18)16-11-4-1-7(6-15-11)13(19)20/h1-6,17H,(H,19,20)(H,15,16,18).
What are the key properties of 6-[(5-fluoro-2-hydroxybenzoyl)amino]pyridine-3-carboxylic acid?
6-[(5-fluoro-2-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 6-[(5-fluoro-2-hydroxybenzoyl)amino]pyridine-3-carboxylic acid is sourced from PubChem (CID 115298481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).