6-(3,4-difluorophenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide

C19H13F3N2O — CID 58639385

IUPAC6-(3,4-difluorophenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(-c3ccc(F)c(F)c3)nc2)cc1F
InChIInChI=1S/C19H13F3N2O/c1-11-2-5-14(9-16(11)21)24-19(25)13-4-7-18(23-10-13)12-3-6-15(20)17(22)8-12/h2-10H,1H3,(H,24,25)
InChIKeyWBZSYNSNYHWAQQ-UHFFFAOYSA-N
MW342.32 g/mol
LogP4.73
Rot. Bonds3

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

6-(3,4-difluorophenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide (PubChem CID 58639385) has the molecular formula C19H13F3N2O and a molecular weight of 342.32 g/mol. Its IUPAC name is 6-(3,4-difluorophenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(3,4-difluorophenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide
PubChem CID58639385
Molecular FormulaC19H13F3N2O
Molecular Weight342.32 g/mol
Exact Mass342.10
IUPAC Name6-(3,4-difluorophenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(-c3ccc(F)c(F)c3)nc2)cc1F
InChIInChI=1S/C19H13F3N2O/c1-11-2-5-14(9-16(11)21)24-19(25)13-4-7-18(23-10-13)12-3-6-15(20)17(22)8-12/h2-10H,1H3,(H,24,25)
InChIKeyWBZSYNSNYHWAQQ-UHFFFAOYSA-N
XLogP4.73
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.32
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-bromo-N-(3,4-difluorophenyl)pyridine-3-carboxamide
CID 66462669
N-(3,4-difluorophenyl)-6-[(4-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109156026
N-(3,4-difluorophenyl)-6-(propylamino)pyridine-3-carboxamide
CID 62166701
methyl 6-[(3-fluoro-4-methylphenyl)carbamoyl]pyridine-3-carboxylate
CID 31809423
N-(3-chloro-4-methylphenyl)-2-(3,4-difluoroanilino)pyrimidine-5-carboxamide
CID 109269177
N-(3,4-difluorophenyl)-2-(dimethylamino)pyrimidine-5-carboxamide
CID 53007857
6-(3-fluorophenyl)-N-phenylpyridine-3-carboxamide
CID 53111120
N-(3-bromo-4-fluorophenyl)-3-fluoro-4-methylbenzamide
CID 115661442
6-(4-fluoro-3-methylphenyl)pyridine-3-carboxylic acid
CID 52984088
N-(3-fluoro-4-methylphenyl)-4-propan-2-yloxybenzamide
CID 7778576
4-ethoxy-N-(3-fluoro-4-methylphenyl)benzamide
CID 2969739
1-N-(3,4-difluorophenyl)-4-N-propan-2-ylbenzene-1,4-dicarboxamide
CID 109043255

Frequently Asked Questions

What is the IUPAC name of 6-(3,4-difluorophenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-(3,4-difluorophenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide (CID 58639385) is 6-(3,4-difluorophenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(3,4-difluorophenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(3,4-difluorophenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide is Cc1ccc(NC(=O)c2ccc(-c3ccc(F)c(F)c3)nc2)cc1F.
What is the InChIKey of 6-(3,4-difluorophenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide?
The InChIKey is WBZSYNSNYHWAQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13F3N2O/c1-11-2-5-14(9-16(11)21)24-19(25)13-4-7-18(23-10-13)12-3-6-15(20)17(22)8-12/h2-10H,1H3,(H,24,25).
What are the key properties of 6-(3,4-difluorophenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide?
6-(3,4-difluorophenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide has a molecular weight of 342.32 g/mol, XLogP of 4.73, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,4-difluorophenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 58639385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).