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

C14H11F3N2O2 — CID 110698735

IUPAC2-methyl-6-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-4-carboxamide
SMILESCc1cc(C(=O)Nc2cccc(C(F)(F)F)c2)cc(=O)[nH]1
InChIInChI=1S/C14H11F3N2O2/c1-8-5-9(6-12(20)18-8)13(21)19-11-4-2-3-10(7-11)14(15,16)17/h2-7H,1H3,(H,18,20)(H,19,21)
InChIKeyFBSVQRASFNWDDM-UHFFFAOYSA-N
MW296.25 g/mol
LogP2.95
Rot. Bonds2

About 2-methyl-6-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-4-carboxamide

2-methyl-6-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-4-carboxamide (PubChem CID 110698735) has the molecular formula C14H11F3N2O2 and a molecular weight of 296.25 g/mol. Its IUPAC name is 2-methyl-6-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-4-carboxamide.

Molecular Properties

Compound Name2-methyl-6-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-4-carboxamide
PubChem CID110698735
Molecular FormulaC14H11F3N2O2
Molecular Weight296.25 g/mol
Exact Mass296.08
IUPAC Name2-methyl-6-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-4-carboxamide
SMILESCc1cc(C(=O)Nc2cccc(C(F)(F)F)c2)cc(=O)[nH]1
InChIInChI=1S/C14H11F3N2O2/c1-8-5-9(6-12(20)18-8)13(21)19-11-4-2-3-10(7-11)14(15,16)17/h2-7H,1H3,(H,18,20)(H,19,21)
InChIKeyFBSVQRASFNWDDM-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

2-methyl-6-oxo-N-[4-(trifluoromethyl)phenyl]-1H-pyridine-4-carboxamide
CID 110698736
4-hydroxy-6-methyl-2-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carboxamide
CID 54713541
3-acetamido-N-[3-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]benzamide
CID 46513424
6-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-3-carboxamide
CID 110860870
N-[3-(trifluoromethyl)phenyl]-1H-pyrrole-3-carboxamide
CID 110691166
1-N,3-N,5-N-tris(3-tert-butylphenyl)benzene-1,3,5-tricarboxamide
CID 67992144
4-hydroxy-3-methyl-N-[3-(trifluoromethyl)phenyl]benzamide
CID 103955327
N-[3-(trifluoromethyl)phenyl]-3-[[3-(trifluoromethyl)phenyl]carbamoylamino]benzamide
CID 2359720
2,3-dioxo-N-[3-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]-1,4-dihydroquinoxaline-6-carboxamide
CID 23474550
N-(3-bromo-4-methylphenyl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide
CID 110698722
4-bromo-N-[3-(trifluoromethyl)phenyl]benzamide
CID 788568
4-sulfanyl-N-[3-(trifluoromethyl)phenyl]benzamide
CID 107020049

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-4-carboxamide?
The IUPAC name of 2-methyl-6-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-4-carboxamide (CID 110698735) is 2-methyl-6-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-4-carboxamide.
What is the SMILES notation for 2-methyl-6-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-4-carboxamide?
The canonical SMILES for 2-methyl-6-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-4-carboxamide is Cc1cc(C(=O)Nc2cccc(C(F)(F)F)c2)cc(=O)[nH]1.
What is the InChIKey of 2-methyl-6-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-4-carboxamide?
The InChIKey is FBSVQRASFNWDDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F3N2O2/c1-8-5-9(6-12(20)18-8)13(21)19-11-4-2-3-10(7-11)14(15,16)17/h2-7H,1H3,(H,18,20)(H,19,21).
What are the key properties of 2-methyl-6-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-4-carboxamide?
2-methyl-6-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-4-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 2-methyl-6-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-4-carboxamide is sourced from PubChem (CID 110698735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).