1-methyl-2-oxo-6-(trifluoromethyl)pyridine-3-carboxamide

C8H7F3N2O2 — CID 39024342

IUPAC1-methyl-2-oxo-6-(trifluoromethyl)pyridine-3-carboxamide
SMILESCn1c(C(F)(F)F)ccc(C(N)=O)c1=O
InChIInChI=1S/C8H7F3N2O2/c1-13-5(8(9,10)11)3-2-4(6(12)14)7(13)15/h2-3H,1H3,(H2,12,14)
InChIKeyOKJDMCVMPBJOGU-UHFFFAOYSA-N
MW220.15 g/mol
LogP0.50
Rot. Bonds1

About 1-methyl-2-oxo-6-(trifluoromethyl)pyridine-3-carboxamide

1-methyl-2-oxo-6-(trifluoromethyl)pyridine-3-carboxamide (PubChem CID 39024342) has the molecular formula C8H7F3N2O2 and a molecular weight of 220.15 g/mol. Its IUPAC name is 1-methyl-2-oxo-6-(trifluoromethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name1-methyl-2-oxo-6-(trifluoromethyl)pyridine-3-carboxamide
PubChem CID39024342
Molecular FormulaC8H7F3N2O2
Molecular Weight220.15 g/mol
Exact Mass220.05
IUPAC Name1-methyl-2-oxo-6-(trifluoromethyl)pyridine-3-carboxamide
SMILESCn1c(C(F)(F)F)ccc(C(N)=O)c1=O
InChIInChI=1S/C8H7F3N2O2/c1-13-5(8(9,10)11)3-2-4(6(12)14)7(13)15/h2-3H,1H3,(H2,12,14)
InChIKeyOKJDMCVMPBJOGU-UHFFFAOYSA-N
XLogP0.50
TPSA65.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.15
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-oxo-6-(trifluoromethyl)pyridine-3-carboxamide?
The IUPAC name of 1-methyl-2-oxo-6-(trifluoromethyl)pyridine-3-carboxamide (CID 39024342) is 1-methyl-2-oxo-6-(trifluoromethyl)pyridine-3-carboxamide.
What is the SMILES notation for 1-methyl-2-oxo-6-(trifluoromethyl)pyridine-3-carboxamide?
The canonical SMILES for 1-methyl-2-oxo-6-(trifluoromethyl)pyridine-3-carboxamide is Cn1c(C(F)(F)F)ccc(C(N)=O)c1=O.
What is the InChIKey of 1-methyl-2-oxo-6-(trifluoromethyl)pyridine-3-carboxamide?
The InChIKey is OKJDMCVMPBJOGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F3N2O2/c1-13-5(8(9,10)11)3-2-4(6(12)14)7(13)15/h2-3H,1H3,(H2,12,14).
What are the key properties of 1-methyl-2-oxo-6-(trifluoromethyl)pyridine-3-carboxamide?
1-methyl-2-oxo-6-(trifluoromethyl)pyridine-3-carboxamide has a molecular weight of 220.15 g/mol, XLogP of 0.50, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-oxo-6-(trifluoromethyl)pyridine-3-carboxamide is sourced from PubChem (CID 39024342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).