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

C13H11FN2O — CID 63972736

IUPAC6-fluoro-N-(3-methylphenyl)pyridine-3-carboxamide
SMILESCc1cccc(NC(=O)c2ccc(F)nc2)c1
InChIInChI=1S/C13H11FN2O/c1-9-3-2-4-11(7-9)16-13(17)10-5-6-12(14)15-8-10/h2-8H,1H3,(H,16,17)
InChIKeyVOEQMUYXWQBORO-UHFFFAOYSA-N
MW230.24 g/mol
LogP2.78
Rot. Bonds2

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

6-fluoro-N-(3-methylphenyl)pyridine-3-carboxamide (PubChem CID 63972736) has the molecular formula C13H11FN2O and a molecular weight of 230.24 g/mol. Its IUPAC name is 6-fluoro-N-(3-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-fluoro-N-(3-methylphenyl)pyridine-3-carboxamide
PubChem CID63972736
Molecular FormulaC13H11FN2O
Molecular Weight230.24 g/mol
Exact Mass230.09
IUPAC Name6-fluoro-N-(3-methylphenyl)pyridine-3-carboxamide
SMILESCc1cccc(NC(=O)c2ccc(F)nc2)c1
InChIInChI=1S/C13H11FN2O/c1-9-3-2-4-11(7-9)16-13(17)10-5-6-12(14)15-8-10/h2-8H,1H3,(H,16,17)
InChIKeyVOEQMUYXWQBORO-UHFFFAOYSA-N
XLogP2.78
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.24
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-fluoro-N-(3-hydroxyphenyl)pyridine-3-carboxamide
CID 63979934
6-hydrazinyl-N-(3-methylphenyl)pyridine-3-carboxamide
CID 51370235
2-(3-methylanilino)-N-(3-methylphenyl)pyrimidine-5-carboxamide
CID 109265476
N-(2-bromo-4-methylphenyl)-6-fluoropyridine-3-carboxamide
CID 63973713
1-N-(4-fluorophenyl)-4-N-(3-methylphenyl)benzene-1,4-dicarboxamide
CID 109049357
2-(3-fluoroanilino)-N-(3-methylphenyl)pyrimidine-5-carboxamide
CID 109265542
6-(3-acetamidoanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 109162236
N-(2,6-dibromo-4-methylphenyl)-6-fluoropyridine-3-carboxamide
CID 63973532
2-methoxy-N-(3-methylphenyl)pyrimidine-5-carboxamide
CID 53337924
N-(3-methylphenyl)-2-phenylpyrimidine-5-carboxamide
CID 3634035
6-(dipropylamino)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 109161795
N-(3-methylphenyl)-6-[3-(trifluoromethyl)anilino]pyridine-3-carboxamide
CID 109162234

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-(3-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-fluoro-N-(3-methylphenyl)pyridine-3-carboxamide (CID 63972736) is 6-fluoro-N-(3-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-fluoro-N-(3-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-fluoro-N-(3-methylphenyl)pyridine-3-carboxamide is Cc1cccc(NC(=O)c2ccc(F)nc2)c1.
What is the InChIKey of 6-fluoro-N-(3-methylphenyl)pyridine-3-carboxamide?
The InChIKey is VOEQMUYXWQBORO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN2O/c1-9-3-2-4-11(7-9)16-13(17)10-5-6-12(14)15-8-10/h2-8H,1H3,(H,16,17).
What are the key properties of 6-fluoro-N-(3-methylphenyl)pyridine-3-carboxamide?
6-fluoro-N-(3-methylphenyl)pyridine-3-carboxamide has a molecular weight of 230.24 g/mol, XLogP of 2.78, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-(3-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 63972736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).