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

C8H7F3N2O2 — CID 155464923

IUPAC5-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
SMILESCc1cc(C(N)=O)c(=O)[nH]c1C(F)(F)F
InChIInChI=1S/C8H7F3N2O2/c1-3-2-4(6(12)14)7(15)13-5(3)8(9,10)11/h2H,1H3,(H2,12,14)(H,13,15)
InChIKeyAEXLOODGAOZZPA-UHFFFAOYSA-N
MW220.15 g/mol
LogP0.80
Rot. Bonds1

About 5-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide

5-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide (PubChem CID 155464923) has the molecular formula C8H7F3N2O2 and a molecular weight of 220.15 g/mol. Its IUPAC name is 5-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name5-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
PubChem CID155464923
Molecular FormulaC8H7F3N2O2
Molecular Weight220.15 g/mol
Exact Mass220.05
IUPAC Name5-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
SMILESCc1cc(C(N)=O)c(=O)[nH]c1C(F)(F)F
InChIInChI=1S/C8H7F3N2O2/c1-3-2-4(6(12)14)7(15)13-5(3)8(9,10)11/h2H,1H3,(H2,12,14)(H,13,15)
InChIKeyAEXLOODGAOZZPA-UHFFFAOYSA-N
XLogP0.80
TPSA75.95 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.15
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The IUPAC name of 5-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide (CID 155464923) is 5-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide.
What is the SMILES notation for 5-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The canonical SMILES for 5-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide is Cc1cc(C(N)=O)c(=O)[nH]c1C(F)(F)F.
What is the InChIKey of 5-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The InChIKey is AEXLOODGAOZZPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F3N2O2/c1-3-2-4(6(12)14)7(15)13-5(3)8(9,10)11/h2H,1H3,(H2,12,14)(H,13,15).
What are the key properties of 5-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
5-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide has a molecular weight of 220.15 g/mol, XLogP of 0.80, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide is sourced from PubChem (CID 155464923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).