6-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carboxamide

C14H11F3N2O2 — CID 110860870

IUPAC6-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carboxamide
SMILESCc1cc(=O)c(C(=O)Nc2cccc(C(F)(F)F)c2)c[nH]1
InChIInChI=1S/C14H11F3N2O2/c1-8-5-12(20)11(7-18-8)13(21)19-10-4-2-3-9(6-10)14(15,16)17/h2-7H,1H3,(H,18,20)(H,19,21)
InChIKeyBPRMGSWICJWDMB-UHFFFAOYSA-N
MW296.25 g/mol
LogP2.95
Rot. Bonds2

About 6-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carboxamide

6-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carboxamide (PubChem CID 110860870) has the molecular formula C14H11F3N2O2 and a molecular weight of 296.25 g/mol. Its IUPAC name is 6-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carboxamide
PubChem CID110860870
Molecular FormulaC14H11F3N2O2
Molecular Weight296.25 g/mol
Exact Mass296.08
IUPAC Name6-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carboxamide
SMILESCc1cc(=O)c(C(=O)Nc2cccc(C(F)(F)F)c2)c[nH]1
InChIInChI=1S/C14H11F3N2O2/c1-8-5-12(20)11(7-18-8)13(21)19-10-4-2-3-9(6-10)14(15,16)17/h2-7H,1H3,(H,18,20)(H,19,21)
InChIKeyBPRMGSWICJWDMB-UHFFFAOYSA-N
XLogP2.95
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.25
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-methyl-4-oxo-N-phenyl-1H-pyridine-3-carboxamide
CID 110856546
3-(3,4-dimethylphenyl)-2,4-dioxo-N-[3-(trifluoromethyl)phenyl]-1H-pyrimidine-5-carboxamide
CID 3627238
N-(3-fluoro-4-methylphenyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 103696188
2-methyl-6-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-4-carboxamide
CID 110698735
N-[3-(ethylaminomethyl)phenyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide;hydrochloride
CID 119438297
4-methyl-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 110860828
2-hydroxy-4-(trifluoromethyl)-N-[3-(trifluoromethyl)phenyl]benzamide
CID 154341283
4-hydroxy-6-methyl-2-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carboxamide
CID 54713541
3-(3,4-dimethoxyphenyl)-2,4-dioxo-N-[3-(trifluoromethyl)phenyl]-1H-pyrimidine-5-carboxamide
CID 16815268
6-methyl-4-oxo-N-[2-[2-(trifluoromethyl)anilino]phenyl]-1H-pyridine-3-carboxamide
CID 166394067
N-[3-(trifluoromethyl)phenyl]-1H-pyrrole-3-carboxamide
CID 110691166
[2-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl] hypobromite
CID 150746432

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carboxamide?
The IUPAC name of 6-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carboxamide (CID 110860870) is 6-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carboxamide.
What is the SMILES notation for 6-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carboxamide?
The canonical SMILES for 6-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carboxamide is Cc1cc(=O)c(C(=O)Nc2cccc(C(F)(F)F)c2)c[nH]1.
What is the InChIKey of 6-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carboxamide?
The InChIKey is BPRMGSWICJWDMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F3N2O2/c1-8-5-12(20)11(7-18-8)13(21)19-10-4-2-3-9(6-10)14(15,16)17/h2-7H,1H3,(H,18,20)(H,19,21).
What are the key properties of 6-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carboxamide?
6-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carboxamide has a molecular weight of 296.25 g/mol, XLogP of 2.95, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carboxamide is sourced from PubChem (CID 110860870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).