5-(2-chlorophenyl)-N-[(4-fluorophenyl)methyl]pyridine-3-carboxamide

C19H14ClFN2O — CID 46032155

IUPAC5-(2-chlorophenyl)-N-[(4-fluorophenyl)methyl]pyridine-3-carboxamide
SMILESO=C(NCc1ccc(F)cc1)c1cncc(-c2ccccc2Cl)c1
InChIInChI=1S/C19H14ClFN2O/c20-18-4-2-1-3-17(18)14-9-15(12-22-11-14)19(24)23-10-13-5-7-16(21)8-6-13/h1-9,11-12H,10H2,(H,23,24)
InChIKeyNALYWKGWIDKMAJ-UHFFFAOYSA-N
MW340.79 g/mol
LogP4.47
Rot. Bonds4

About 5-(2-chlorophenyl)-N-[(4-fluorophenyl)methyl]pyridine-3-carboxamide

5-(2-chlorophenyl)-N-[(4-fluorophenyl)methyl]pyridine-3-carboxamide (PubChem CID 46032155) has the molecular formula C19H14ClFN2O and a molecular weight of 340.79 g/mol. Its IUPAC name is 5-(2-chlorophenyl)-N-[(4-fluorophenyl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(2-chlorophenyl)-N-[(4-fluorophenyl)methyl]pyridine-3-carboxamide
PubChem CID46032155
Molecular FormulaC19H14ClFN2O
Molecular Weight340.79 g/mol
Exact Mass340.08
IUPAC Name5-(2-chlorophenyl)-N-[(4-fluorophenyl)methyl]pyridine-3-carboxamide
SMILESO=C(NCc1ccc(F)cc1)c1cncc(-c2ccccc2Cl)c1
InChIInChI=1S/C19H14ClFN2O/c20-18-4-2-1-3-17(18)14-9-15(12-22-11-14)19(24)23-10-13-5-7-16(21)8-6-13/h1-9,11-12H,10H2,(H,23,24)
InChIKeyNALYWKGWIDKMAJ-UHFFFAOYSA-N
XLogP4.47
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.79
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(1-benzothiophen-2-yl)-N-[(4-fluorophenyl)methyl]pyridine-3-carboxamide
CID 46154523
N-benzyl-5-(3-fluorophenyl)pyridine-3-carboxamide
CID 42845762
N-[(4-fluorophenyl)methyl]-5-(4-methoxyphenyl)pyridine-3-carboxamide
CID 53020814
5-(2-chlorophenyl)-N-propan-2-ylpyridine-3-carboxamide
CID 46032150
5-(4-fluorophenyl)-N-[(3-methylphenyl)methyl]pyridine-3-carboxamide
CID 53020754
5-(2-chlorophenyl)-N-[(4-fluorophenyl)methyl]furan-2-carboxamide
CID 9083579
3-N-[(2-chlorophenyl)methyl]-1-N-[(4-fluorophenyl)methyl]benzene-1,3-dicarboxamide
CID 109054654
5-N-(3,4-difluorophenyl)-3-N-[(4-fluorophenyl)methyl]pyridine-3,5-dicarboxamide
CID 109105648
5-chloro-N-[(4-fluorophenyl)methyl]-6-(methylamino)pyridine-3-carboxamide
CID 62167616
5-(2-fluorophenyl)-N-(2-phenylethyl)pyridine-3-carboxamide
CID 46033116
5-(2-methylphenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 46032131
2,6-dichloro-N-[(4-fluorophenyl)methyl]benzamide
CID 841148

Frequently Asked Questions

What is the IUPAC name of 5-(2-chlorophenyl)-N-[(4-fluorophenyl)methyl]pyridine-3-carboxamide?
The IUPAC name of 5-(2-chlorophenyl)-N-[(4-fluorophenyl)methyl]pyridine-3-carboxamide (CID 46032155) is 5-(2-chlorophenyl)-N-[(4-fluorophenyl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-(2-chlorophenyl)-N-[(4-fluorophenyl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 5-(2-chlorophenyl)-N-[(4-fluorophenyl)methyl]pyridine-3-carboxamide is O=C(NCc1ccc(F)cc1)c1cncc(-c2ccccc2Cl)c1.
What is the InChIKey of 5-(2-chlorophenyl)-N-[(4-fluorophenyl)methyl]pyridine-3-carboxamide?
The InChIKey is NALYWKGWIDKMAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14ClFN2O/c20-18-4-2-1-3-17(18)14-9-15(12-22-11-14)19(24)23-10-13-5-7-16(21)8-6-13/h1-9,11-12H,10H2,(H,23,24).
What are the key properties of 5-(2-chlorophenyl)-N-[(4-fluorophenyl)methyl]pyridine-3-carboxamide?
5-(2-chlorophenyl)-N-[(4-fluorophenyl)methyl]pyridine-3-carboxamide has a molecular weight of 340.79 g/mol, XLogP of 4.47, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-chlorophenyl)-N-[(4-fluorophenyl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 46032155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).