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

C18H12ClF2N3O — CID 109199191

IUPACN-(3-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-2-carboxamide
SMILESO=C(Nc1cccc(Cl)c1)c1ccc(Nc2ccc(F)cc2F)cn1
InChIInChI=1S/C18H12ClF2N3O/c19-11-2-1-3-13(8-11)24-18(25)17-7-5-14(10-22-17)23-16-6-4-12(20)9-15(16)21/h1-10,23H,(H,24,25)
InChIKeyRDYGQVKJNDMYLO-UHFFFAOYSA-N
MW359.76 g/mol
LogP5.01
Rot. Bonds4

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

N-(3-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-2-carboxamide (PubChem CID 109199191) has the molecular formula C18H12ClF2N3O and a molecular weight of 359.76 g/mol. Its IUPAC name is N-(3-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-2-carboxamide
PubChem CID109199191
Molecular FormulaC18H12ClF2N3O
Molecular Weight359.76 g/mol
Exact Mass359.06
IUPAC NameN-(3-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-2-carboxamide
SMILESO=C(Nc1cccc(Cl)c1)c1ccc(Nc2ccc(F)cc2F)cn1
InChIInChI=1S/C18H12ClF2N3O/c19-11-2-1-3-13(8-11)24-18(25)17-7-5-14(10-22-17)23-16-6-4-12(20)9-15(16)21/h1-10,23H,(H,24,25)
InChIKeyRDYGQVKJNDMYLO-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-difluoroanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide
CID 109198992
5-(2,4-difluoroanilino)-N-(3,5-dimethylphenyl)pyridine-2-carboxamide
CID 109198177
5-anilino-N-(2,4-difluorophenyl)pyridine-2-carboxamide
CID 109197129
N-(3-chlorophenyl)-5-(4-methylanilino)pyridine-2-carboxamide
CID 109197509
5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-2-carboxamide
CID 109200665
N-(2,4-dichlorophenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide
CID 109198930
N-(3-chlorophenyl)-5-(4-fluoroanilino)pyrazine-2-carboxamide
CID 109292535
1-(3-chlorophenyl)-3-(2,4-difluorophenyl)urea
CID 898171
5-(2,4-difluoroanilino)-N-(2-methoxyphenyl)pyridine-2-carboxamide
CID 109199705
N-tert-butyl-5-(2,4-difluoroanilino)pyridine-2-carboxamide
CID 109195143
N-[2-(4-chlorophenyl)ethyl]-5-(2,4-difluoroanilino)pyridine-2-carboxamide
CID 109193674
6-N-(2,4-difluorophenyl)-2-N-(3,4-difluorophenyl)pyridine-2,6-dicarboxamide
CID 109101086

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-2-carboxamide?
The IUPAC name of N-(3-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-2-carboxamide (CID 109199191) is N-(3-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-(3-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-2-carboxamide?
The canonical SMILES for N-(3-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-2-carboxamide is O=C(Nc1cccc(Cl)c1)c1ccc(Nc2ccc(F)cc2F)cn1.
What is the InChIKey of N-(3-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-2-carboxamide?
The InChIKey is RDYGQVKJNDMYLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12ClF2N3O/c19-11-2-1-3-13(8-11)24-18(25)17-7-5-14(10-22-17)23-16-6-4-12(20)9-15(16)21/h1-10,23H,(H,24,25).
What are the key properties of N-(3-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-2-carboxamide?
N-(3-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-2-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-(3-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109199191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).