5-fluoro-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide

C13H11FN2O2 — CID 115694821

IUPAC5-fluoro-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide
SMILESCc1cc(O)ccc1NC(=O)c1cncc(F)c1
InChIInChI=1S/C13H11FN2O2/c1-8-4-11(17)2-3-12(8)16-13(18)9-5-10(14)7-15-6-9/h2-7,17H,1H3,(H,16,18)
InChIKeyBMMGCHRKFWQDPA-UHFFFAOYSA-N
MW246.24 g/mol
LogP2.49
Rot. Bonds2

About 5-fluoro-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide

5-fluoro-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide (PubChem CID 115694821) has the molecular formula C13H11FN2O2 and a molecular weight of 246.24 g/mol. Its IUPAC name is 5-fluoro-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-fluoro-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide
PubChem CID115694821
Molecular FormulaC13H11FN2O2
Molecular Weight246.24 g/mol
Exact Mass246.08
IUPAC Name5-fluoro-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide
SMILESCc1cc(O)ccc1NC(=O)c1cncc(F)c1
InChIInChI=1S/C13H11FN2O2/c1-8-4-11(17)2-3-12(8)16-13(18)9-5-10(14)7-15-6-9/h2-7,17H,1H3,(H,16,18)
InChIKeyBMMGCHRKFWQDPA-UHFFFAOYSA-N
XLogP2.49
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.24
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

5-fluoro-N-(2-methyl-4-sulfamoylphenyl)pyridine-3-carboxamide
CID 104786047
4-[(5-fluoropyridine-3-carbonyl)amino]-3-methylbenzenesulfonyl chloride
CID 104785746
2-chloro-5-fluoro-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide
CID 114034241
5-fluoro-N-(3-hydroxyphenyl)pyridine-3-carboxamide
CID 113287958
5-hydroxy-N-[2-methyl-4-(methylcarbamoyl)phenyl]pyridine-3-carboxamide
CID 63860452
5-N-(2,4-dimethylphenyl)-3-N-(4-methylphenyl)pyridine-3,5-dicarboxamide
CID 109107985
3-fluoro-4-[(5-fluoropyridine-3-carbonyl)amino]benzoic acid
CID 115867825
methyl 4-[(5-hydroxypyridine-3-carbonyl)amino]-3-methylbenzoate
CID 63859252
2-[(5-fluoropyridine-3-carbonyl)amino]-5-methoxybenzoic acid
CID 104785687
N-(2,4-dimethylphenyl)-5-(4-fluoroanilino)pyridine-3-carboxamide
CID 109242670
N-(4-fluoro-2-methylphenyl)-3,5-dihydroxybenzamide
CID 103891547
5-fluoro-N-(4-methyl-1H-pyrazol-5-yl)pyridine-3-carboxamide
CID 115694727

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 5-fluoro-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide (CID 115694821) is 5-fluoro-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-fluoro-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-fluoro-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide is Cc1cc(O)ccc1NC(=O)c1cncc(F)c1.
What is the InChIKey of 5-fluoro-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide?
The InChIKey is BMMGCHRKFWQDPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN2O2/c1-8-4-11(17)2-3-12(8)16-13(18)9-5-10(14)7-15-6-9/h2-7,17H,1H3,(H,16,18).
What are the key properties of 5-fluoro-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide?
5-fluoro-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide has a molecular weight of 246.24 g/mol, XLogP of 2.49, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 115694821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).