5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide

C18H12F3N3O — CID 109246109

IUPAC5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide
SMILESO=C(Nc1cccc(F)c1)c1cncc(Nc2c(F)cccc2F)c1
InChIInChI=1S/C18H12F3N3O/c19-12-3-1-4-13(8-12)24-18(25)11-7-14(10-22-9-11)23-17-15(20)5-2-6-16(17)21/h1-10,23H,(H,24,25)
InChIKeyNGRHADYEXIJKOV-UHFFFAOYSA-N
MW343.31 g/mol
LogP4.49
Rot. Bonds4

About 5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide

5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide (PubChem CID 109246109) has the molecular formula C18H12F3N3O and a molecular weight of 343.31 g/mol. Its IUPAC name is 5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide
PubChem CID109246109
Molecular FormulaC18H12F3N3O
Molecular Weight343.31 g/mol
Exact Mass343.09
IUPAC Name5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide
SMILESO=C(Nc1cccc(F)c1)c1cncc(Nc2c(F)cccc2F)c1
InChIInChI=1S/C18H12F3N3O/c19-12-3-1-4-13(8-12)24-18(25)11-7-14(10-22-9-11)23-17-15(20)5-2-6-16(17)21/h1-10,23H,(H,24,25)
InChIKeyNGRHADYEXIJKOV-UHFFFAOYSA-N
XLogP4.49
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.31
LogP ≤ 54.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2,6-difluoroanilino)-N-(3,4-difluorophenyl)pyridine-3-carboxamide
CID 109246460
N-(3-fluorophenyl)-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide
CID 109233510
5-(2,6-difluoroanilino)pyridine-3-carboxylic acid
CID 82535068
N-tert-butyl-5-(2,6-difluoroanilino)pyridine-3-carboxamide
CID 109239372
5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-2-carboxamide
CID 109200665
5-(3-fluoroanilino)-N-(4-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide
CID 109246036
5-(5-chloro-2-methoxyanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide
CID 109245070
N-(3-fluorophenyl)-5-(pyridin-4-ylmethylamino)pyridine-3-carboxamide
CID 109235741
5-(2,6-difluoroanilino)-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109245567
N-(3-fluorophenyl)-5-(2-phenylethylamino)pyridine-3-carboxamide
CID 109235989
5-N-(3-fluorophenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
CID 109106241
N-(3-fluorophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide
CID 109245541

Frequently Asked Questions

What is the IUPAC name of 5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide?
The IUPAC name of 5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide (CID 109246109) is 5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide is O=C(Nc1cccc(F)c1)c1cncc(Nc2c(F)cccc2F)c1.
What is the InChIKey of 5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide?
The InChIKey is NGRHADYEXIJKOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12F3N3O/c19-12-3-1-4-13(8-12)24-18(25)11-7-14(10-22-9-11)23-17-15(20)5-2-6-16(17)21/h1-10,23H,(H,24,25).
What are the key properties of 5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide?
5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide has a molecular weight of 343.31 g/mol, XLogP of 4.49, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109246109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).