2-(2,3-difluorophenyl)-6-(trifluoromethyl)pyridine-3-carboxamide

C13H7F5N2O — CID 170837724

IUPAC2-(2,3-difluorophenyl)-6-(trifluoromethyl)pyridine-3-carboxamide
SMILESNC(=O)c1ccc(C(F)(F)F)nc1-c1cccc(F)c1F
InChIInChI=1S/C13H7F5N2O/c14-8-3-1-2-6(10(8)15)11-7(12(19)21)4-5-9(20-11)13(16,17)18/h1-5H,(H2,19,21)
InChIKeyBFYJTNLRZQAATA-UHFFFAOYSA-N
MW302.20 g/mol
LogP3.14
Rot. Bonds2

About 2-(2,3-difluorophenyl)-6-(trifluoromethyl)pyridine-3-carboxamide

2-(2,3-difluorophenyl)-6-(trifluoromethyl)pyridine-3-carboxamide (PubChem CID 170837724) has the molecular formula C13H7F5N2O and a molecular weight of 302.20 g/mol. Its IUPAC name is 2-(2,3-difluorophenyl)-6-(trifluoromethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(2,3-difluorophenyl)-6-(trifluoromethyl)pyridine-3-carboxamide
PubChem CID170837724
Molecular FormulaC13H7F5N2O
Molecular Weight302.20 g/mol
Exact Mass302.05
IUPAC Name2-(2,3-difluorophenyl)-6-(trifluoromethyl)pyridine-3-carboxamide
SMILESNC(=O)c1ccc(C(F)(F)F)nc1-c1cccc(F)c1F
InChIInChI=1S/C13H7F5N2O/c14-8-3-1-2-6(10(8)15)11-7(12(19)21)4-5-9(20-11)13(16,17)18/h1-5H,(H2,19,21)
InChIKeyBFYJTNLRZQAATA-UHFFFAOYSA-N
XLogP3.14
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.20
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Methylquinoline-8-carboxamide
CID 21195867
6-(3-Fluorophenyl)-N-[1-(2,2,2-Trifluoroethyl)piperidin-4-Yl]pyridine-3-Carboxamide
CID 24991044
2-Ethylquinoline-8-carboxamide
CID 25208752
2-Fluoranyl-~{n}-[2-(4-Fluorophenyl)-6-Methyl-Pyridin-3-Yl]-4-(Trifluoromethyl)benzamide
CID 123131777
N-(2-fluorophenyl)-2-methyl-6-(trifluoromethyl)nicotinamide
CID 2795899
[2-Methyl-6-(trifluoromethyl)pyridin-3-yl](piperidino)methanone
CID 2796058
7-Amino-2-methylquinoline-5,8-dione
CID 10976237
6-(3-Fluorophenyl)pyridine-3-carboxamide
CID 20609874
7-Acetamido-2-methylquinoline-5,8-dione
CID 9834526
6-(Trifluoromethyl)nicotinamide
CID 2777545
N-[3,5-Bis(trifluoromethyl)benzyl]-4-phenyl-N,2,6-trimethylnicotinamide
CID 54580277
N-[3,5-Bis(trifluoromethyl)benzyl]-2,6-dimethyl-4-phenylnicotinamide
CID 54585203

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-difluorophenyl)-6-(trifluoromethyl)pyridine-3-carboxamide?
The IUPAC name of 2-(2,3-difluorophenyl)-6-(trifluoromethyl)pyridine-3-carboxamide (CID 170837724) is 2-(2,3-difluorophenyl)-6-(trifluoromethyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-(2,3-difluorophenyl)-6-(trifluoromethyl)pyridine-3-carboxamide?
The canonical SMILES for 2-(2,3-difluorophenyl)-6-(trifluoromethyl)pyridine-3-carboxamide is NC(=O)c1ccc(C(F)(F)F)nc1-c1cccc(F)c1F.
What is the InChIKey of 2-(2,3-difluorophenyl)-6-(trifluoromethyl)pyridine-3-carboxamide?
The InChIKey is BFYJTNLRZQAATA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7F5N2O/c14-8-3-1-2-6(10(8)15)11-7(12(19)21)4-5-9(20-11)13(16,17)18/h1-5H,(H2,19,21).
What are the key properties of 2-(2,3-difluorophenyl)-6-(trifluoromethyl)pyridine-3-carboxamide?
2-(2,3-difluorophenyl)-6-(trifluoromethyl)pyridine-3-carboxamide has a molecular weight of 302.20 g/mol, XLogP of 3.14, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-difluorophenyl)-6-(trifluoromethyl)pyridine-3-carboxamide is sourced from PubChem (CID 170837724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).