N-(2,4-difluorophenyl)-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide

C19H12F5N3O — CID 109200283

IUPACN-(2,4-difluorophenyl)-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)c1ccc(Nc2ccccc2C(F)(F)F)cn1
InChIInChI=1S/C19H12F5N3O/c20-11-5-7-16(14(21)9-11)27-18(28)17-8-6-12(10-25-17)26-15-4-2-1-3-13(15)19(22,23)24/h1-10,26H,(H,27,28)
InChIKeyWWJUMODAGUXDFT-UHFFFAOYSA-N
MW393.32 g/mol
LogP5.37
Rot. Bonds4

About N-(2,4-difluorophenyl)-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide

N-(2,4-difluorophenyl)-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide (PubChem CID 109200283) has the molecular formula C19H12F5N3O and a molecular weight of 393.32 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide
PubChem CID109200283
Molecular FormulaC19H12F5N3O
Molecular Weight393.32 g/mol
Exact Mass393.09
IUPAC NameN-(2,4-difluorophenyl)-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)c1ccc(Nc2ccccc2C(F)(F)F)cn1
InChIInChI=1S/C19H12F5N3O/c20-11-5-7-16(14(21)9-11)27-18(28)17-8-6-12(10-25-17)26-15-4-2-1-3-13(15)19(22,23)24/h1-10,26H,(H,27,28)
InChIKeyWWJUMODAGUXDFT-UHFFFAOYSA-N
XLogP5.37
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500393.32
LogP ≤ 55.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-anilino-N-(2,4-difluorophenyl)pyridine-2-carboxamide
CID 109197129
5-(2,6-difluoroanilino)-N-[2-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 109200277
5-(2,4-difluoroanilino)-N-(2-methoxyphenyl)pyridine-2-carboxamide
CID 109199705
5-(2,4-difluoroanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide
CID 109198992
5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide
CID 67532141
2-(2,4-difluoroanilino)-N-[2-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide
CID 109270001
5-hydrazinyl-N-[2-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 104642157
N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-2-carboxamide
CID 109198012
N-(2-fluorophenyl)-4-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide
CID 109220614
N-cyclopentyl-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide
CID 109182289
N-(2,4-difluorophenyl)-2-(trifluoromethyl)benzamide
CID 2524391
5-(4-methoxyanilino)-N-[2-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 109199921

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide?
The IUPAC name of N-(2,4-difluorophenyl)-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide (CID 109200283) is N-(2,4-difluorophenyl)-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide?
The canonical SMILES for N-(2,4-difluorophenyl)-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide is O=C(Nc1ccc(F)cc1F)c1ccc(Nc2ccccc2C(F)(F)F)cn1.
What is the InChIKey of N-(2,4-difluorophenyl)-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide?
The InChIKey is WWJUMODAGUXDFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12F5N3O/c20-11-5-7-16(14(21)9-11)27-18(28)17-8-6-12(10-25-17)26-15-4-2-1-3-13(15)19(22,23)24/h1-10,26H,(H,27,28).
What are the key properties of N-(2,4-difluorophenyl)-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide?
N-(2,4-difluorophenyl)-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide has a molecular weight of 393.32 g/mol, XLogP of 5.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide is sourced from PubChem (CID 109200283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).