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

C8H7F3N2O2 — CID 14043512

IUPAC4-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
SMILESCc1cc(C(F)(F)F)[nH]c(=O)c1C(N)=O
InChIInChI=1S/C8H7F3N2O2/c1-3-2-4(8(9,10)11)13-7(15)5(3)6(12)14/h2H,1H3,(H2,12,14)(H,13,15)
InChIKeyISPYTJOFALZLCQ-UHFFFAOYSA-N
MW220.15 g/mol
LogP0.80
Rot. Bonds1

About 4-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide

4-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide (PubChem CID 14043512) has the molecular formula C8H7F3N2O2 and a molecular weight of 220.15 g/mol. Its IUPAC name is 4-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name4-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
PubChem CID14043512
Molecular FormulaC8H7F3N2O2
Molecular Weight220.15 g/mol
Exact Mass220.05
IUPAC Name4-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
SMILESCc1cc(C(F)(F)F)[nH]c(=O)c1C(N)=O
InChIInChI=1S/C8H7F3N2O2/c1-3-2-4(8(9,10)11)13-7(15)5(3)6(12)14/h2H,1H3,(H2,12,14)(H,13,15)
InChIKeyISPYTJOFALZLCQ-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 4-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The IUPAC name of 4-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide (CID 14043512) is 4-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide.
What is the SMILES notation for 4-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The canonical SMILES for 4-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide is Cc1cc(C(F)(F)F)[nH]c(=O)c1C(N)=O.
What is the InChIKey of 4-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The InChIKey is ISPYTJOFALZLCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F3N2O2/c1-3-2-4(8(9,10)11)13-7(15)5(3)6(12)14/h2H,1H3,(H2,12,14)(H,13,15).
What are the key properties of 4-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
4-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 4-methyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide is sourced from PubChem (CID 14043512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).