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

C10H6F8N2O2 — CID 144685135

IUPAC2-oxo-6-(1,1,2,2,3-pentafluoropropyl)-4-(trifluoromethyl)-1H-pyridine-3-carboxamide
SMILESNC(=O)c1c(C(F)(F)F)cc(C(F)(F)C(F)(F)CF)[nH]c1=O
InChIInChI=1S/C10H6F8N2O2/c11-2-8(12,13)9(14,15)4-1-3(10(16,17)18)5(6(19)21)7(22)20-4/h1H,2H2,(H2,19,21)(H,20,22)
InChIKeyVPIAERXQKOIJNS-UHFFFAOYSA-N
MW338.15 g/mol
LogP2.19
Rot. Bonds4

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

2-oxo-6-(1,1,2,2,3-pentafluoropropyl)-4-(trifluoromethyl)-1H-pyridine-3-carboxamide (PubChem CID 144685135) has the molecular formula C10H6F8N2O2 and a molecular weight of 338.15 g/mol. Its IUPAC name is 2-oxo-6-(1,1,2,2,3-pentafluoropropyl)-4-(trifluoromethyl)-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name2-oxo-6-(1,1,2,2,3-pentafluoropropyl)-4-(trifluoromethyl)-1H-pyridine-3-carboxamide
PubChem CID144685135
Molecular FormulaC10H6F8N2O2
Molecular Weight338.15 g/mol
Exact Mass338.03
IUPAC Name2-oxo-6-(1,1,2,2,3-pentafluoropropyl)-4-(trifluoromethyl)-1H-pyridine-3-carboxamide
SMILESNC(=O)c1c(C(F)(F)F)cc(C(F)(F)C(F)(F)CF)[nH]c1=O
InChIInChI=1S/C10H6F8N2O2/c11-2-8(12,13)9(14,15)4-1-3(10(16,17)18)5(6(19)21)7(22)20-4/h1H,2H2,(H2,19,21)(H,20,22)
InChIKeyVPIAERXQKOIJNS-UHFFFAOYSA-N
XLogP2.19
TPSA75.95 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.15
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-oxo-6-(1,1,2,2,3-pentafluoropropyl)-4-(trifluoromethyl)-1H-pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-Hydroxy-6-(trifluoromethyl)nicotinamide
CID 2775114
3-Acetyl-6-(trifluoromethyl)-1,2-dihydropyridin-2-one
CID 14043510
2-oxo-4,6-bis(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 11065630
2-Hydroxy-4-methyl-6-(trifluoromethyl)nicotinamide
CID 14043512
2-Oxo-6-(pentafluoroethyl)-1,2-dihydropyridine-3-carboxamide
CID 59828238
N-Methyl-2-oxo-6-(1,1,2,2-tetrafluoroethyl)-1,2-dihydropyridine-3-carboxamide
CID 59828241
6-(Heptafluoropropyl)-2-oxo-N-propyl-1,2-dihydropyridine-3-carboxamide
CID 59828242
6-(1-Chloro-1,2,2,2-tetrafluoroethyl)-2-oxo-1,2-dihydropyridine-3-carboxamide
CID 59828248
4-oxo-2,6-bis(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 85617167
6-(2-Chloro-1,1,2,2-tetrafluoroethyl)-2-oxo-1,2-dihydropyridine-3-carboxamide
CID 86624095
2-oxo-6-(1,1,2,2,2-pentafluoroethyl)-4-(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 89690179
6-(1,1,2,2,3,3,3-heptafluoropropyl)-2-oxo-4-(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 90344265

Frequently Asked Questions

What is the IUPAC name of 2-oxo-6-(1,1,2,2,3-pentafluoropropyl)-4-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The IUPAC name of 2-oxo-6-(1,1,2,2,3-pentafluoropropyl)-4-(trifluoromethyl)-1H-pyridine-3-carboxamide (CID 144685135) is 2-oxo-6-(1,1,2,2,3-pentafluoropropyl)-4-(trifluoromethyl)-1H-pyridine-3-carboxamide.
What is the SMILES notation for 2-oxo-6-(1,1,2,2,3-pentafluoropropyl)-4-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The canonical SMILES for 2-oxo-6-(1,1,2,2,3-pentafluoropropyl)-4-(trifluoromethyl)-1H-pyridine-3-carboxamide is NC(=O)c1c(C(F)(F)F)cc(C(F)(F)C(F)(F)CF)[nH]c1=O.
What is the InChIKey of 2-oxo-6-(1,1,2,2,3-pentafluoropropyl)-4-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The InChIKey is VPIAERXQKOIJNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6F8N2O2/c11-2-8(12,13)9(14,15)4-1-3(10(16,17)18)5(6(19)21)7(22)20-4/h1H,2H2,(H2,19,21)(H,20,22).
What are the key properties of 2-oxo-6-(1,1,2,2,3-pentafluoropropyl)-4-(trifluoromethyl)-1H-pyridine-3-carboxamide?
2-oxo-6-(1,1,2,2,3-pentafluoropropyl)-4-(trifluoromethyl)-1H-pyridine-3-carboxamide has a molecular weight of 338.15 g/mol, XLogP of 2.19, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-6-(1,1,2,2,3-pentafluoropropyl)-4-(trifluoromethyl)-1H-pyridine-3-carboxamide is sourced from PubChem (CID 144685135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).