N-methyl-2-oxo-6-(1,1,2,2-tetrafluoroethyl)-1H-pyridine-3-carboxamide

C9H8F4N2O2 — CID 59828241

IUPACN-methyl-2-oxo-6-(1,1,2,2-tetrafluoroethyl)-1H-pyridine-3-carboxamide
SMILESCNC(=O)c1ccc(C(F)(F)C(F)F)[nH]c1=O
InChIInChI=1S/C9H8F4N2O2/c1-14-6(16)4-2-3-5(15-7(4)17)9(12,13)8(10)11/h2-3,8H,1H3,(H,14,16)(H,15,17)
InChIKeySVGHZPMWNQQISF-UHFFFAOYSA-N
MW252.17 g/mol
LogP1.09
Rot. Bonds3

About N-methyl-2-oxo-6-(1,1,2,2-tetrafluoroethyl)-1H-pyridine-3-carboxamide

N-methyl-2-oxo-6-(1,1,2,2-tetrafluoroethyl)-1H-pyridine-3-carboxamide (PubChem CID 59828241) has the molecular formula C9H8F4N2O2 and a molecular weight of 252.17 g/mol. Its IUPAC name is N-methyl-2-oxo-6-(1,1,2,2-tetrafluoroethyl)-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-2-oxo-6-(1,1,2,2-tetrafluoroethyl)-1H-pyridine-3-carboxamide
PubChem CID59828241
Molecular FormulaC9H8F4N2O2
Molecular Weight252.17 g/mol
Exact Mass252.05
IUPAC NameN-methyl-2-oxo-6-(1,1,2,2-tetrafluoroethyl)-1H-pyridine-3-carboxamide
SMILESCNC(=O)c1ccc(C(F)(F)C(F)F)[nH]c1=O
InChIInChI=1S/C9H8F4N2O2/c1-14-6(16)4-2-3-5(15-7(4)17)9(12,13)8(10)11/h2-3,8H,1H3,(H,14,16)(H,15,17)
InChIKeySVGHZPMWNQQISF-UHFFFAOYSA-N
XLogP1.09
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.17
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methylpent-2-enamide
CID 72155658
2-oxo-4,6-bis(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 11065630
2-Hydroxy-4-methyl-6-(trifluoromethyl)nicotinamide
CID 14043512
N,N-dimethyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 25030824
1-Methyl-2-oxo-6-(trifluoromethyl)pyridine-3-carboxamide
CID 39024342
6-ethyl-5-methyl-2-oxo-N-propan-2-yl-1-(4,4,4-trifluorobutyl)pyridine-3-carboxamide
CID 59718858
6-(2-Chloro-1,1,2,2-tetrafluoroethyl)-N-ethyl-2-oxo-1,2-dihydropyridine-3-carboxamide
CID 59828235
2-Oxo-6-(pentafluoroethyl)-1,2-dihydropyridine-3-carboxamide
CID 59828238
6-(Difluoromethyl)-N-isopropyl-2-oxo-1,2-dihydropyridine-3-carboxamide
CID 59828239
5-Chloro-N,N-diethyl-6-(heptafluoropropyl)-2-oxo-1,2-dihydropyridine-3-carboxamide
CID 59828240
6-(Heptafluoropropyl)-2-oxo-N-propyl-1,2-dihydropyridine-3-carboxamide
CID 59828242
2-Oxo-N-(2-propynyl)-6-(1,1,2,2-tetrafluoroethyl)-1,2-dihydropyridine-3-carboxamide
CID 59828245

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-oxo-6-(1,1,2,2-tetrafluoroethyl)-1H-pyridine-3-carboxamide?
The IUPAC name of N-methyl-2-oxo-6-(1,1,2,2-tetrafluoroethyl)-1H-pyridine-3-carboxamide (CID 59828241) is N-methyl-2-oxo-6-(1,1,2,2-tetrafluoroethyl)-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-2-oxo-6-(1,1,2,2-tetrafluoroethyl)-1H-pyridine-3-carboxamide?
The canonical SMILES for N-methyl-2-oxo-6-(1,1,2,2-tetrafluoroethyl)-1H-pyridine-3-carboxamide is CNC(=O)c1ccc(C(F)(F)C(F)F)[nH]c1=O.
What is the InChIKey of N-methyl-2-oxo-6-(1,1,2,2-tetrafluoroethyl)-1H-pyridine-3-carboxamide?
The InChIKey is SVGHZPMWNQQISF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F4N2O2/c1-14-6(16)4-2-3-5(15-7(4)17)9(12,13)8(10)11/h2-3,8H,1H3,(H,14,16)(H,15,17).
What are the key properties of N-methyl-2-oxo-6-(1,1,2,2-tetrafluoroethyl)-1H-pyridine-3-carboxamide?
N-methyl-2-oxo-6-(1,1,2,2-tetrafluoroethyl)-1H-pyridine-3-carboxamide has a molecular weight of 252.17 g/mol, XLogP of 1.09, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-oxo-6-(1,1,2,2-tetrafluoroethyl)-1H-pyridine-3-carboxamide is sourced from PubChem (CID 59828241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).