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

C18H12F3N3O — CID 109200665

IUPAC5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-2-carboxamide
SMILESO=C(Nc1cccc(F)c1)c1ccc(Nc2c(F)cccc2F)cn1
InChIInChI=1S/C18H12F3N3O/c19-11-3-1-4-12(9-11)24-18(25)16-8-7-13(10-22-16)23-17-14(20)5-2-6-15(17)21/h1-10,23H,(H,24,25)
InChIKeyCVXRUJIPQWATRW-UHFFFAOYSA-N
MW343.31 g/mol
LogP4.49
Rot. Bonds4

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

5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-2-carboxamide (PubChem CID 109200665) 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-2-carboxamide.

Molecular Properties

Compound Name5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-2-carboxamide
PubChem CID109200665
Molecular FormulaC18H12F3N3O
Molecular Weight343.31 g/mol
Exact Mass343.09
IUPAC Name5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-2-carboxamide
SMILESO=C(Nc1cccc(F)c1)c1ccc(Nc2c(F)cccc2F)cn1
InChIInChI=1S/C18H12F3N3O/c19-11-3-1-4-12(9-11)24-18(25)16-8-7-13(10-22-16)23-17-14(20)5-2-6-15(17)21/h1-10,23H,(H,24,25)
InChIKeyCVXRUJIPQWATRW-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-dimethoxyphenyl)pyridine-2-carboxamide
CID 109200253
5-(3-fluoroanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide
CID 109199794
5-(3-fluoroanilino)-N-[3-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 109200292
N-(3-fluorophenyl)-5-(propylamino)pyridine-2-carboxamide
CID 109179399
5-(2,6-difluoroanilino)-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide
CID 109200966
5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide
CID 109246109
5-(2,6-difluoroanilino)-N-(4-pyrrolidin-1-ylphenyl)pyridine-2-carboxamide
CID 109200601
N-(3-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-2-carboxamide
CID 109199191
5-(cyclohexylamino)-N-(3-fluorophenyl)pyridine-2-carboxamide
CID 109183205
5-(2-fluoroanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide
CID 109292440
5-(2,6-difluoroanilino)-N-[2-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 109200277
5-(3,4-difluoroanilino)-N-(3,4-difluorophenyl)pyridine-2-carboxamide
CID 109200977

Frequently Asked Questions

What is the IUPAC name of 5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-2-carboxamide?
The IUPAC name of 5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-2-carboxamide (CID 109200665) is 5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-2-carboxamide is O=C(Nc1cccc(F)c1)c1ccc(Nc2c(F)cccc2F)cn1.
What is the InChIKey of 5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-2-carboxamide?
The InChIKey is CVXRUJIPQWATRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12F3N3O/c19-11-3-1-4-12(9-11)24-18(25)16-8-7-13(10-22-16)23-17-14(20)5-2-6-15(17)21/h1-10,23H,(H,24,25).
What are the key properties of 5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-2-carboxamide?
5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-2-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-2-carboxamide is sourced from PubChem (CID 109200665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).