N-(2,4-dichlorophenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide

C18H12Cl2FN3O — CID 109198930

IUPACN-(2,4-dichlorophenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1Cl)c1ccc(Nc2ccccc2F)cn1
InChIInChI=1S/C18H12Cl2FN3O/c19-11-5-7-15(13(20)9-11)24-18(25)17-8-6-12(10-22-17)23-16-4-2-1-3-14(16)21/h1-10,23H,(H,24,25)
InChIKeyPEMXOOWJHAKJTH-UHFFFAOYSA-N
MW376.22 g/mol
LogP5.52
Rot. Bonds4

About N-(2,4-dichlorophenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide

N-(2,4-dichlorophenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide (PubChem CID 109198930) has the molecular formula C18H12Cl2FN3O and a molecular weight of 376.22 g/mol. Its IUPAC name is N-(2,4-dichlorophenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2,4-dichlorophenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide
PubChem CID109198930
Molecular FormulaC18H12Cl2FN3O
Molecular Weight376.22 g/mol
Exact Mass375.03
IUPAC NameN-(2,4-dichlorophenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1Cl)c1ccc(Nc2ccccc2F)cn1
InChIInChI=1S/C18H12Cl2FN3O/c19-11-5-7-15(13(20)9-11)24-18(25)17-8-6-12(10-22-17)23-16-4-2-1-3-14(16)21/h1-10,23H,(H,24,25)
InChIKeyPEMXOOWJHAKJTH-UHFFFAOYSA-N
XLogP5.52
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.22
LogP ≤ 55.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,4-dimethylphenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide
CID 109197955
5-(2,6-dichloroanilino)-N-(2-fluorophenyl)pyridine-2-carboxamide
CID 109198867
N-(3-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-2-carboxamide
CID 109199191
N-(4-acetylphenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide
CID 109198907
N-tert-butyl-5-(2-fluoroanilino)pyridine-2-carboxamide
CID 109195085
N-(2-fluorophenyl)-5-(2-propan-2-ylanilino)pyridine-2-carboxamide
CID 109198647
5-(2,4-difluoroanilino)-N-(2-methoxyphenyl)pyridine-2-carboxamide
CID 109199705
5-(3-bromoanilino)-N-(2-fluorophenyl)pyridine-2-carboxamide
CID 109198855
5-(2,4-difluoroanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide
CID 109198992
5-(2-fluoroanilino)-N-(4-propan-2-yloxyphenyl)pyridine-2-carboxamide
CID 109198899
5-anilino-N-(2,4-difluorophenyl)pyridine-2-carboxamide
CID 109197129
5-anilino-N-(3-chloro-4-fluorophenyl)pyridine-2-carboxamide
CID 109197085

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dichlorophenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide?
The IUPAC name of N-(2,4-dichlorophenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide (CID 109198930) is N-(2,4-dichlorophenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-(2,4-dichlorophenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide?
The canonical SMILES for N-(2,4-dichlorophenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide is O=C(Nc1ccc(Cl)cc1Cl)c1ccc(Nc2ccccc2F)cn1.
What is the InChIKey of N-(2,4-dichlorophenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide?
The InChIKey is PEMXOOWJHAKJTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12Cl2FN3O/c19-11-5-7-15(13(20)9-11)24-18(25)17-8-6-12(10-22-17)23-16-4-2-1-3-14(16)21/h1-10,23H,(H,24,25).
What are the key properties of N-(2,4-dichlorophenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide?
N-(2,4-dichlorophenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide has a molecular weight of 376.22 g/mol, XLogP of 5.52, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dichlorophenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109198930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).