N-(3-chloro-4-fluorophenyl)-6-oxo-5-phenyl-1H-pyridine-3-carboxamide

C18H12ClFN2O2 — CID 110683825

IUPACN-(3-chloro-4-fluorophenyl)-6-oxo-5-phenyl-1H-pyridine-3-carboxamide
SMILESO=C(Nc1ccc(F)c(Cl)c1)c1c[nH]c(=O)c(-c2ccccc2)c1
InChIInChI=1S/C18H12ClFN2O2/c19-15-9-13(6-7-16(15)20)22-17(23)12-8-14(18(24)21-10-12)11-4-2-1-3-5-11/h1-10H,(H,21,24)(H,22,23)
InChIKeyYXWIGRAYQYDNBG-UHFFFAOYSA-N
MW342.76 g/mol
LogP4.09
Rot. Bonds3

About N-(3-chloro-4-fluorophenyl)-6-oxo-5-phenyl-1H-pyridine-3-carboxamide

N-(3-chloro-4-fluorophenyl)-6-oxo-5-phenyl-1H-pyridine-3-carboxamide (PubChem CID 110683825) has the molecular formula C18H12ClFN2O2 and a molecular weight of 342.76 g/mol. Its IUPAC name is N-(3-chloro-4-fluorophenyl)-6-oxo-5-phenyl-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-chloro-4-fluorophenyl)-6-oxo-5-phenyl-1H-pyridine-3-carboxamide
PubChem CID110683825
Molecular FormulaC18H12ClFN2O2
Molecular Weight342.76 g/mol
Exact Mass342.06
IUPAC NameN-(3-chloro-4-fluorophenyl)-6-oxo-5-phenyl-1H-pyridine-3-carboxamide
SMILESO=C(Nc1ccc(F)c(Cl)c1)c1c[nH]c(=O)c(-c2ccccc2)c1
InChIInChI=1S/C18H12ClFN2O2/c19-15-9-13(6-7-16(15)20)22-17(23)12-8-14(18(24)21-10-12)11-4-2-1-3-5-11/h1-10H,(H,21,24)(H,22,23)
InChIKeyYXWIGRAYQYDNBG-UHFFFAOYSA-N
XLogP4.09
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.76
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,4-difluorophenyl)-6-oxo-5-phenyl-1H-pyridine-3-carboxamide
CID 110683863
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-oxo-5-phenyl-1H-pyridine-3-carboxamide
CID 110683849
N-(3-chloro-4-fluorophenyl)-2-oxo-6-(4-phenylphenyl)-1H-pyridine-3-carboxamide
CID 66498018
N-(3-chloro-4-fluorophenyl)-1H-pyrrole-3-carboxamide
CID 110691150
4-[(3-chloro-4-fluorophenyl)carbamoyl]benzoic acid
CID 43386528
2-benzamido-N-(3-chloro-4-fluorophenyl)-1,3-thiazole-4-carboxamide
CID 16914974
N-(3-chloro-4-fluorophenyl)-1H-pyrazole-4-carboxamide
CID 43532923
4-amino-N-(3-chloro-4-fluorophenyl)-3,5-difluorobenzamide
CID 63187581
2,5-dichloro-N-(3-chloro-4-fluorophenyl)benzamide
CID 690469
N-(3-chloro-4-fluorophenyl)-2-iodobenzamide
CID 615783
4-chloro-N-(3-chloro-4-fluorophenyl)-3-sulfanylbenzamide
CID 167246589
1-N-(3-chloro-4-fluorophenyl)-3-N-(2-fluorophenyl)benzene-1,3-dicarboxamide
CID 109057416

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-fluorophenyl)-6-oxo-5-phenyl-1H-pyridine-3-carboxamide?
The IUPAC name of N-(3-chloro-4-fluorophenyl)-6-oxo-5-phenyl-1H-pyridine-3-carboxamide (CID 110683825) is N-(3-chloro-4-fluorophenyl)-6-oxo-5-phenyl-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(3-chloro-4-fluorophenyl)-6-oxo-5-phenyl-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(3-chloro-4-fluorophenyl)-6-oxo-5-phenyl-1H-pyridine-3-carboxamide is O=C(Nc1ccc(F)c(Cl)c1)c1c[nH]c(=O)c(-c2ccccc2)c1.
What is the InChIKey of N-(3-chloro-4-fluorophenyl)-6-oxo-5-phenyl-1H-pyridine-3-carboxamide?
The InChIKey is YXWIGRAYQYDNBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12ClFN2O2/c19-15-9-13(6-7-16(15)20)22-17(23)12-8-14(18(24)21-10-12)11-4-2-1-3-5-11/h1-10H,(H,21,24)(H,22,23).
What are the key properties of N-(3-chloro-4-fluorophenyl)-6-oxo-5-phenyl-1H-pyridine-3-carboxamide?
N-(3-chloro-4-fluorophenyl)-6-oxo-5-phenyl-1H-pyridine-3-carboxamide has a molecular weight of 342.76 g/mol, XLogP of 4.09, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-fluorophenyl)-6-oxo-5-phenyl-1H-pyridine-3-carboxamide is sourced from PubChem (CID 110683825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).