N-(2,6-dichlorophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide

C18H12Cl2FN3O — CID 109220710

IUPACN-(2,6-dichlorophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide
SMILESO=C(Nc1c(Cl)cccc1Cl)c1cc(Nc2ccccc2F)ccn1
InChIInChI=1S/C18H12Cl2FN3O/c19-12-4-3-5-13(20)17(12)24-18(25)16-10-11(8-9-22-16)23-15-7-2-1-6-14(15)21/h1-10H,(H,22,23)(H,24,25)
InChIKeyNYTFQQQHOSFXIP-UHFFFAOYSA-N
MW376.22 g/mol
LogP5.52
Rot. Bonds4

About N-(2,6-dichlorophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide

N-(2,6-dichlorophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide (PubChem CID 109220710) has the molecular formula C18H12Cl2FN3O and a molecular weight of 376.22 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide
PubChem CID109220710
Molecular FormulaC18H12Cl2FN3O
Molecular Weight376.22 g/mol
Exact Mass375.03
IUPAC NameN-(2,6-dichlorophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide
SMILESO=C(Nc1c(Cl)cccc1Cl)c1cc(Nc2ccccc2F)ccn1
InChIInChI=1S/C18H12Cl2FN3O/c19-12-4-3-5-13(20)17(12)24-18(25)16-10-11(8-9-22-16)23-15-7-2-1-6-14(15)21/h1-10H,(H,22,23)(H,24,25)
InChIKeyNYTFQQQHOSFXIP-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-(2,6-difluorophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide
CID 109220720
N-(2-chlorophenyl)-4-(2,6-difluoroanilino)pyridine-2-carboxamide
CID 109220893
N-(2-bromophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide
CID 109220697
4-(3-chloro-4-methylanilino)-N-(2-fluorophenyl)pyridine-2-carboxamide
CID 109220598
N-(2-fluorophenyl)-4-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide
CID 109220614
4-(3-chloro-2-fluoroanilino)pyridine-2-carboxylic acid
CID 43326161
N-(2-fluorophenyl)-4-hydrazinylpyridine-2-carboxamide
CID 62249933
4-(2,6-difluoroanilino)-N-[2-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 109222054
4-(2-fluoroanilino)-N-pentylpyridine-2-carboxamide
CID 109217523
2-N-(2-chlorophenyl)-4-N-(2-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109092591
4-(3-acetamidoanilino)-N-(2-chlorophenyl)pyridine-2-carboxamide
CID 109220873
N-(2-fluorophenyl)-4-(4-methoxyanilino)pyridine-2-carboxamide
CID 109220605

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide?
The IUPAC name of N-(2,6-dichlorophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide (CID 109220710) is N-(2,6-dichlorophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide?
The canonical SMILES for N-(2,6-dichlorophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide is O=C(Nc1c(Cl)cccc1Cl)c1cc(Nc2ccccc2F)ccn1.
What is the InChIKey of N-(2,6-dichlorophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide?
The InChIKey is NYTFQQQHOSFXIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12Cl2FN3O/c19-12-4-3-5-13(20)17(12)24-18(25)16-10-11(8-9-22-16)23-15-7-2-1-6-14(15)21/h1-10H,(H,22,23)(H,24,25).
What are the key properties of N-(2,6-dichlorophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide?
N-(2,6-dichlorophenyl)-4-(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-(2,6-dichlorophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109220710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).