N-(4-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-3-carboxamide

C18H12ClF2N3O — CID 109244598

IUPACN-(4-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-3-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)c1cncc(Nc2ccc(F)cc2F)c1
InChIInChI=1S/C18H12ClF2N3O/c19-12-1-4-14(5-2-12)24-18(25)11-7-15(10-22-9-11)23-17-6-3-13(20)8-16(17)21/h1-10,23H,(H,24,25)
InChIKeyQKTQQYYBFLPBSX-UHFFFAOYSA-N
MW359.76 g/mol
LogP5.01
Rot. Bonds4

About N-(4-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-3-carboxamide

N-(4-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-3-carboxamide (PubChem CID 109244598) has the molecular formula C18H12ClF2N3O and a molecular weight of 359.76 g/mol. Its IUPAC name is N-(4-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-3-carboxamide
PubChem CID109244598
Molecular FormulaC18H12ClF2N3O
Molecular Weight359.76 g/mol
Exact Mass359.06
IUPAC NameN-(4-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-3-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)c1cncc(Nc2ccc(F)cc2F)c1
InChIInChI=1S/C18H12ClF2N3O/c19-12-1-4-14(5-2-12)24-18(25)11-7-15(10-22-9-11)23-17-6-3-13(20)8-16(17)21/h1-10,23H,(H,24,25)
InChIKeyQKTQQYYBFLPBSX-UHFFFAOYSA-N
XLogP5.01
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.76
LogP ≤ 55.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2,4-dichloroanilino)-N-(4-fluorophenyl)pyridine-3-carboxamide
CID 109244281
N-(2,4-difluorophenyl)-5-(2,3,4-trifluoroanilino)pyridine-3-carboxamide
CID 109246256
5-(3-chloroanilino)-N-(2,4-difluorophenyl)pyridine-3-carboxamide
CID 109244550
N-(1,3-benzodioxol-5-yl)-5-(2,4-difluoroanilino)pyridine-3-carboxamide
CID 109246164
5-(2,4-difluoroanilino)-N-(2,4-dimethylphenyl)pyridine-3-carboxamide
CID 109242709
5-(5-chloro-2-methylanilino)-N-(4-chlorophenyl)pyridine-3-carboxamide
CID 109244563
N-(3,5-dichlorophenyl)-5-(4-fluoroanilino)pyridine-3-carboxamide
CID 109244351
N-(4-chloro-2-methylphenyl)-5-(4-fluoroanilino)pyridine-3-carboxamide
CID 109244302
N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-3-carboxamide
CID 109242767
N-(4-chlorophenyl)-5-[(4-fluorophenyl)methylamino]pyridine-3-carboxamide
CID 109233729
5-(2,4-difluoroanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide
CID 109198992
5-(2,4-difluoroanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide
CID 109236485

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-3-carboxamide?
The IUPAC name of N-(4-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-3-carboxamide (CID 109244598) is N-(4-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-3-carboxamide.
What is the SMILES notation for N-(4-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-3-carboxamide?
The canonical SMILES for N-(4-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-3-carboxamide is O=C(Nc1ccc(Cl)cc1)c1cncc(Nc2ccc(F)cc2F)c1.
What is the InChIKey of N-(4-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-3-carboxamide?
The InChIKey is QKTQQYYBFLPBSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12ClF2N3O/c19-12-1-4-14(5-2-12)24-18(25)11-7-15(10-22-9-11)23-17-6-3-13(20)8-16(17)21/h1-10,23H,(H,24,25).
What are the key properties of N-(4-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-3-carboxamide?
N-(4-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-3-carboxamide has a molecular weight of 359.76 g/mol, XLogP of 5.01, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-3-carboxamide is sourced from PubChem (CID 109244598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).