2-fluoro-N-(6-methyl-2-pyridinyl)-3-(trifluoromethyl)benzamide

C14H10F4N2O — CID 79883704

IUPAC2-fluoro-N-(6-methyl-2-pyridinyl)-3-(trifluoromethyl)benzamide
SMILESCc1cccc(NC(=O)c2cccc(C(F)(F)F)c2F)n1
InChIInChI=1S/C14H10F4N2O/c1-8-4-2-7-11(19-8)20-13(21)9-5-3-6-10(12(9)15)14(16,17)18/h2-7H,1H3,(H,19,20,21)
InChIKeyQINCDYKIZGGBBE-UHFFFAOYSA-N
MW298.24 g/mol
LogP3.80
Rot. Bonds2

About 2-fluoro-N-(6-methyl-2-pyridinyl)-3-(trifluoromethyl)benzamide

2-fluoro-N-(6-methyl-2-pyridinyl)-3-(trifluoromethyl)benzamide (PubChem CID 79883704) has the molecular formula C14H10F4N2O and a molecular weight of 298.24 g/mol. Its IUPAC name is 2-fluoro-N-(6-methyl-2-pyridinyl)-3-(trifluoromethyl)benzamide.

Molecular Properties

Compound Name2-fluoro-N-(6-methyl-2-pyridinyl)-3-(trifluoromethyl)benzamide
PubChem CID79883704
Molecular FormulaC14H10F4N2O
Molecular Weight298.24 g/mol
Exact Mass298.07
IUPAC Name2-fluoro-N-(6-methyl-2-pyridinyl)-3-(trifluoromethyl)benzamide
SMILESCc1cccc(NC(=O)c2cccc(C(F)(F)F)c2F)n1
InChIInChI=1S/C14H10F4N2O/c1-8-4-2-7-11(19-8)20-13(21)9-5-3-6-10(12(9)15)14(16,17)18/h2-7H,1H3,(H,19,20,21)
InChIKeyQINCDYKIZGGBBE-UHFFFAOYSA-N
XLogP3.80
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.24
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-N-hydroxy-3-(trifluoromethyl)benzamide
CID 18696136
N-(4-bromo-2-pyridinyl)-2-fluoro-3-(trifluoromethyl)benzamide
CID 102674046
N-(4-chloro-2-pyridinyl)-2-fluoro-3-(trifluoromethyl)benzamide
CID 115681910
2-acetamido-N-(6-methyl-2-pyridinyl)benzamide
CID 3354177
3-fluoro-N-(6-methyl-2-pyridinyl)pyridine-4-carboxamide
CID 115645542
N-(4,6-dimethylpyrimidin-2-yl)-2-(trifluoromethyl)benzamide
CID 108808047
2-fluoro-N-(1H-pyrazol-5-yl)-3-(trifluoromethyl)benzamide
CID 79885826
N-butan-2-yl-2-fluoro-3-(trifluoromethyl)benzamide
CID 79885795
2-fluoro-N-(1,2-oxazol-4-yl)-3-(trifluoromethyl)benzamide
CID 79884775
2-fluoro-N-[(2-methylpropan-2-yl)oxy]-3-(trifluoromethyl)benzamide
CID 82723802
2-fluoro-N-(2-methylbut-3-yn-2-yl)-3-(trifluoromethyl)benzamide
CID 79885632
methyl 2-[[2-fluoro-3-(trifluoromethyl)benzoyl]amino]acetate
CID 79885001

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(6-methyl-2-pyridinyl)-3-(trifluoromethyl)benzamide?
The IUPAC name of 2-fluoro-N-(6-methyl-2-pyridinyl)-3-(trifluoromethyl)benzamide (CID 79883704) is 2-fluoro-N-(6-methyl-2-pyridinyl)-3-(trifluoromethyl)benzamide.
What is the SMILES notation for 2-fluoro-N-(6-methyl-2-pyridinyl)-3-(trifluoromethyl)benzamide?
The canonical SMILES for 2-fluoro-N-(6-methyl-2-pyridinyl)-3-(trifluoromethyl)benzamide is Cc1cccc(NC(=O)c2cccc(C(F)(F)F)c2F)n1.
What is the InChIKey of 2-fluoro-N-(6-methyl-2-pyridinyl)-3-(trifluoromethyl)benzamide?
The InChIKey is QINCDYKIZGGBBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F4N2O/c1-8-4-2-7-11(19-8)20-13(21)9-5-3-6-10(12(9)15)14(16,17)18/h2-7H,1H3,(H,19,20,21).
What are the key properties of 2-fluoro-N-(6-methyl-2-pyridinyl)-3-(trifluoromethyl)benzamide?
2-fluoro-N-(6-methyl-2-pyridinyl)-3-(trifluoromethyl)benzamide has a molecular weight of 298.24 g/mol, XLogP of 3.80, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(6-methyl-2-pyridinyl)-3-(trifluoromethyl)benzamide is sourced from PubChem (CID 79883704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).