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

C7H5F3N2O2 — CID 2775114

IUPAC2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
SMILESNC(=O)c1ccc(C(F)(F)F)[nH]c1=O
InChIInChI=1S/C7H5F3N2O2/c8-7(9,10)4-2-1-3(5(11)13)6(14)12-4/h1-2H,(H2,11,13)(H,12,14)
InChIKeyBZMWJLRKOIRLSU-UHFFFAOYSA-N
MW206.12 g/mol
LogP0.49
Rot. Bonds1

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

2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide (PubChem CID 2775114) has the molecular formula C7H5F3N2O2 and a molecular weight of 206.12 g/mol. Its IUPAC name is 2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
PubChem CID2775114
Molecular FormulaC7H5F3N2O2
Molecular Weight206.12 g/mol
Exact Mass206.03
IUPAC Name2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
SMILESNC(=O)c1ccc(C(F)(F)F)[nH]c1=O
InChIInChI=1S/C7H5F3N2O2/c8-7(9,10)4-2-1-3(5(11)13)6(14)12-4/h1-2H,(H2,11,13)(H,12,14)
InChIKeyBZMWJLRKOIRLSU-UHFFFAOYSA-N
XLogP0.49
TPSA75.95 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.12
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-Hydroxy-6-methylpyridine-3-carboxamide
CID 261085
1,2-Dihydro-2-oxo-6-(trifluoromethyl)-3-pyridinecarboxaldehyde
CID 118704032
2-oxo-4,6-bis(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 11065630
2-Hydroxy-4-methyl-6-(trifluoromethyl)nicotinamide
CID 14043512
2(1H)-Pyridinone, 6-methyl-3-(trifluoromethyl)-
CID 20767670
6-[Chloro(difluoro)methyl]-2-oxo-1,2-dihydropyridine-3-carboxamide
CID 22113414
N,N-dimethyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 25030824
1-Methyl-2-oxo-6-(trifluoromethyl)pyridine-3-carboxamide
CID 39024342
3-Methyl-6-(trifluoromethyl)-1,2-dihydropyridin-2-one
CID 59340901
6-(Difluoromethyl)-2-hydroxypyridine-3-carboxamide
CID 59828229
5-Chloro-2-oxo-6-(trifluoromethyl)-1,2-dihydropyridine-3-carboxamide
CID 59828234
2-Oxo-6-(pentafluoroethyl)-1,2-dihydropyridine-3-carboxamide
CID 59828238

Frequently Asked Questions

What is the IUPAC name of 2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The IUPAC name of 2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide (CID 2775114) is 2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide.
What is the SMILES notation for 2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The canonical SMILES for 2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide is NC(=O)c1ccc(C(F)(F)F)[nH]c1=O.
What is the InChIKey of 2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The InChIKey is BZMWJLRKOIRLSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F3N2O2/c8-7(9,10)4-2-1-3(5(11)13)6(14)12-4/h1-2H,(H2,11,13)(H,12,14).
What are the key properties of 2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide has a molecular weight of 206.12 g/mol, XLogP of 0.49, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide is sourced from PubChem (CID 2775114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).