N-(5-acetyl-2-pyridinyl)-2-(trifluoromethyl)benzamide

C15H11F3N2O2 — CID 84591908

IUPACN-(5-acetyl-2-pyridinyl)-2-(trifluoromethyl)benzamide
SMILESCC(=O)c1ccc(NC(=O)c2ccccc2C(F)(F)F)nc1
InChIInChI=1S/C15H11F3N2O2/c1-9(21)10-6-7-13(19-8-10)20-14(22)11-4-2-3-5-12(11)15(16,17)18/h2-8H,1H3,(H,19,20,22)
InChIKeyDZARSJGLVKICQH-UHFFFAOYSA-N
MW308.26 g/mol
LogP3.56
Rot. Bonds3

About N-(5-acetyl-2-pyridinyl)-2-(trifluoromethyl)benzamide

N-(5-acetyl-2-pyridinyl)-2-(trifluoromethyl)benzamide (PubChem CID 84591908) has the molecular formula C15H11F3N2O2 and a molecular weight of 308.26 g/mol. Its IUPAC name is N-(5-acetyl-2-pyridinyl)-2-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-(5-acetyl-2-pyridinyl)-2-(trifluoromethyl)benzamide
PubChem CID84591908
Molecular FormulaC15H11F3N2O2
Molecular Weight308.26 g/mol
Exact Mass308.08
IUPAC NameN-(5-acetyl-2-pyridinyl)-2-(trifluoromethyl)benzamide
SMILESCC(=O)c1ccc(NC(=O)c2ccccc2C(F)(F)F)nc1
InChIInChI=1S/C15H11F3N2O2/c1-9(21)10-6-7-13(19-8-10)20-14(22)11-4-2-3-5-12(11)15(16,17)18/h2-8H,1H3,(H,19,20,22)
InChIKeyDZARSJGLVKICQH-UHFFFAOYSA-N
XLogP3.56
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.26
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-acetyl-2-pyridinyl)-6-(trifluoromethyl)pyridine-3-carboxamide
CID 167658935
methyl 4-methyl-6-[[2-(trifluoromethyl)benzoyl]amino]pyridine-3-carboxylate
CID 170250393
2-(trifluoromethyl)-N-[3-[[5-(trifluoromethyl)-2-pyridinyl]carbamoyl]phenyl]benzamide
CID 87570856
6-(methylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 62186448
6-[[4-fluoro-2-(trifluoromethyl)benzoyl]amino]pyridine-3-carboxylic acid
CID 22099714
N-(2-phenylpyrimidin-4-yl)-2-(trifluoromethyl)benzamide
CID 71848765
N-(5-piperazin-1-yl-2-pyridinyl)-2-(trifluoromethyl)benzamide;hydrochloride
CID 119494232
6-[(2-hydroxybenzoyl)amino]pyridine-3-carboxylic acid
CID 61317349
N-(5-methyl-1,3-thiazol-2-yl)-2-(trifluoromethyl)benzamide
CID 4813517
6-[[4-fluoro-2-(trifluoromethyl)benzoyl]amino]pyridine-3-carbonyl chloride
CID 22099637
N-methyl-2-(trifluoromethyl)benzamide
CID 4216112
N-[2-[4-(6-acetamido-3-pyridinyl)-2-(trifluoromethyl)phenyl]-2,2-difluoroethyl]-2-(trifluoromethyl)benzamide
CID 126586990

Frequently Asked Questions

What is the IUPAC name of N-(5-acetyl-2-pyridinyl)-2-(trifluoromethyl)benzamide?
The IUPAC name of N-(5-acetyl-2-pyridinyl)-2-(trifluoromethyl)benzamide (CID 84591908) is N-(5-acetyl-2-pyridinyl)-2-(trifluoromethyl)benzamide.
What is the SMILES notation for N-(5-acetyl-2-pyridinyl)-2-(trifluoromethyl)benzamide?
The canonical SMILES for N-(5-acetyl-2-pyridinyl)-2-(trifluoromethyl)benzamide is CC(=O)c1ccc(NC(=O)c2ccccc2C(F)(F)F)nc1.
What is the InChIKey of N-(5-acetyl-2-pyridinyl)-2-(trifluoromethyl)benzamide?
The InChIKey is DZARSJGLVKICQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F3N2O2/c1-9(21)10-6-7-13(19-8-10)20-14(22)11-4-2-3-5-12(11)15(16,17)18/h2-8H,1H3,(H,19,20,22).
What are the key properties of N-(5-acetyl-2-pyridinyl)-2-(trifluoromethyl)benzamide?
N-(5-acetyl-2-pyridinyl)-2-(trifluoromethyl)benzamide has a molecular weight of 308.26 g/mol, XLogP of 3.56, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetyl-2-pyridinyl)-2-(trifluoromethyl)benzamide is sourced from PubChem (CID 84591908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).