4-methyl-N-[1-methyl-2-oxo-6-(trifluoromethyl)-3-pyridinyl]benzamide

C15H13F3N2O2 — CID 2461566

IUPAC4-methyl-N-[1-methyl-2-oxo-6-(trifluoromethyl)-3-pyridinyl]benzamide
SMILESCc1ccc(C(=O)Nc2ccc(C(F)(F)F)n(C)c2=O)cc1
InChIInChI=1S/C15H13F3N2O2/c1-9-3-5-10(6-4-9)13(21)19-11-7-8-12(15(16,17)18)20(2)14(11)22/h3-8H,1-2H3,(H,19,21)
InChIKeyXHKPRPYZXAWAGM-UHFFFAOYSA-N
MW310.28 g/mol
LogP2.96
Rot. Bonds2

About 4-methyl-N-[1-methyl-2-oxo-6-(trifluoromethyl)-3-pyridinyl]benzamide

4-methyl-N-[1-methyl-2-oxo-6-(trifluoromethyl)-3-pyridinyl]benzamide (PubChem CID 2461566) has the molecular formula C15H13F3N2O2 and a molecular weight of 310.28 g/mol. Its IUPAC name is 4-methyl-N-[1-methyl-2-oxo-6-(trifluoromethyl)-3-pyridinyl]benzamide.

Molecular Properties

Compound Name4-methyl-N-[1-methyl-2-oxo-6-(trifluoromethyl)-3-pyridinyl]benzamide
PubChem CID2461566
Molecular FormulaC15H13F3N2O2
Molecular Weight310.28 g/mol
Exact Mass310.09
IUPAC Name4-methyl-N-[1-methyl-2-oxo-6-(trifluoromethyl)-3-pyridinyl]benzamide
SMILESCc1ccc(C(=O)Nc2ccc(C(F)(F)F)n(C)c2=O)cc1
InChIInChI=1S/C15H13F3N2O2/c1-9-3-5-10(6-4-9)13(21)19-11-7-8-12(15(16,17)18)20(2)14(11)22/h3-8H,1-2H3,(H,19,21)
InChIKeyXHKPRPYZXAWAGM-UHFFFAOYSA-N
XLogP2.96
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.28
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-Dimethyl-p-trifluorobenzamide
CID 141240
4-(4-Methylbenzoyl)piperazine-2,6-dione
CID 576804
N-[(Z)-1-(4-fluorophenyl)-3-(4-methylpiperazin-1-yl)-3-oxoprop-1-en-2-yl]benzamide
CID 1724396
(4-Methylpiperazin-1-yl)-[4-(trifluoromethyl)phenyl]methanone;hydrochloride
CID 16196020
4-methyl-N-(2-oxoazepan-3-yl)benzamide
CID 2813200
2-(3-Ethylamino-2-oxo-6-phenyl-2H-pyridin-1-yl)-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide
CID 10093766
2-(3-Amino-2-oxo-6-phenyl-2H-pyridin-1-yl)-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide
CID 10250073
Benzamide, N-(2-phenyl-1-(1-piperidinylcarbonyl)ethenyl)-, (E)-
CID 781134
N-[1-(4-Methyl-piperidine-1-carbonyl)-2-phenyl-vinyl]-benzamide
CID 5391769
N-(2-amino-2-oxoethyl)benzamide
CID 238721
N-(Benzoylglycyl)glycine amide
CID 3560665
N-[(2S)-1-oxo-1-[[(E,3S)-6-oxo-1-phenylhept-4-en-3-yl]amino]-3-phenylpropan-2-yl]-4-(trifluoromethyl)benzamide
CID 155567513

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[1-methyl-2-oxo-6-(trifluoromethyl)-3-pyridinyl]benzamide?
The IUPAC name of 4-methyl-N-[1-methyl-2-oxo-6-(trifluoromethyl)-3-pyridinyl]benzamide (CID 2461566) is 4-methyl-N-[1-methyl-2-oxo-6-(trifluoromethyl)-3-pyridinyl]benzamide.
What is the SMILES notation for 4-methyl-N-[1-methyl-2-oxo-6-(trifluoromethyl)-3-pyridinyl]benzamide?
The canonical SMILES for 4-methyl-N-[1-methyl-2-oxo-6-(trifluoromethyl)-3-pyridinyl]benzamide is Cc1ccc(C(=O)Nc2ccc(C(F)(F)F)n(C)c2=O)cc1.
What is the InChIKey of 4-methyl-N-[1-methyl-2-oxo-6-(trifluoromethyl)-3-pyridinyl]benzamide?
The InChIKey is XHKPRPYZXAWAGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3N2O2/c1-9-3-5-10(6-4-9)13(21)19-11-7-8-12(15(16,17)18)20(2)14(11)22/h3-8H,1-2H3,(H,19,21).
What are the key properties of 4-methyl-N-[1-methyl-2-oxo-6-(trifluoromethyl)-3-pyridinyl]benzamide?
4-methyl-N-[1-methyl-2-oxo-6-(trifluoromethyl)-3-pyridinyl]benzamide has a molecular weight of 310.28 g/mol, XLogP of 2.96, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[1-methyl-2-oxo-6-(trifluoromethyl)-3-pyridinyl]benzamide is sourced from PubChem (CID 2461566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).