6-fluoro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide

C13H11FN2O2 — CID 113290192

IUPAC6-fluoro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(F)nc2)cc1O
InChIInChI=1S/C13H11FN2O2/c1-8-2-4-10(6-11(8)17)16-13(18)9-3-5-12(14)15-7-9/h2-7,17H,1H3,(H,16,18)
InChIKeyMOQKELDGPAGTSJ-UHFFFAOYSA-N
MW246.24 g/mol
LogP2.49
Rot. Bonds2

About 6-fluoro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide

6-fluoro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide (PubChem CID 113290192) has the molecular formula C13H11FN2O2 and a molecular weight of 246.24 g/mol. Its IUPAC name is 6-fluoro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-fluoro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide
PubChem CID113290192
Molecular FormulaC13H11FN2O2
Molecular Weight246.24 g/mol
Exact Mass246.08
IUPAC Name6-fluoro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(F)nc2)cc1O
InChIInChI=1S/C13H11FN2O2/c1-8-2-4-10(6-11(8)17)16-13(18)9-3-5-12(14)15-7-9/h2-7,17H,1H3,(H,16,18)
InChIKeyMOQKELDGPAGTSJ-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': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 6-fluoro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-(4-(diethylamino)-2-hydroxybenzylidene)isonicotinohydrazide
CID 135400298
N-(3-methoxyphenyl)nicotinamide
CID 668900
2-hydroxy-N-(pyridin-3-yl)benzamide
CID 578240
N-Nicotinoyl tyramine
CID 3043417
N-[(E)-[4-(diethylamino)-2-hydroxyphenyl]methylideneamino]-2-[[2-(trifluoromethyl)-4-pyridinyl]amino]benzamide
CID 135968272
N-[(E)-[4-(diethylamino)-2-hydroxyphenyl]methylideneamino]-4-[[2-(trifluoromethyl)-4-pyridinyl]amino]benzamide
CID 135968274
SCFSkp2-IN-2
CID 135457298
2-hydroxy-N-(pyridin-4-yl)benzamide
CID 578630
N'-[(E)-(2-hydroxyphenyl)methylidene]pyridine-3-carbohydrazide
CID 135455524
N-(4-fluorophenyl)-6-[(2-hydroxyphenyl)methyl-methylamino]pyridine-3-carboxamide
CID 56649673
5-fluoro-N-(4-(1-(4-hydroxyphenyl)cyclopropyl)phenyl)-4-methylnicotinamide
CID 71010096
3-Pyridinecarboxamide, N-(4-(1-hydroxy-2,2,2-trifluoroethyl)phenyl)-
CID 3058191

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-fluoro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide (CID 113290192) is 6-fluoro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-fluoro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-fluoro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide is Cc1ccc(NC(=O)c2ccc(F)nc2)cc1O.
What is the InChIKey of 6-fluoro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide?
The InChIKey is MOQKELDGPAGTSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN2O2/c1-8-2-4-10(6-11(8)17)16-13(18)9-3-5-12(14)15-7-9/h2-7,17H,1H3,(H,16,18).
What are the key properties of 6-fluoro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide?
6-fluoro-N-(3-hydroxy-4-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 6-fluoro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 113290192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).