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

C9H7F3N2O2 — CID 170699866

IUPAC4-ethenyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
SMILESC=Cc1cc(C(F)(F)F)[nH]c(=O)c1C(N)=O
InChIInChI=1S/C9H7F3N2O2/c1-2-4-3-5(9(10,11)12)14-8(16)6(4)7(13)15/h2-3H,1H2,(H2,13,15)(H,14,16)
InChIKeyAZGLLCFHRIMZFA-UHFFFAOYSA-N
MW232.16 g/mol
LogP1.14
Rot. Bonds2

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

4-ethenyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide (PubChem CID 170699866) has the molecular formula C9H7F3N2O2 and a molecular weight of 232.16 g/mol. Its IUPAC name is 4-ethenyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name4-ethenyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
PubChem CID170699866
Molecular FormulaC9H7F3N2O2
Molecular Weight232.16 g/mol
Exact Mass232.05
IUPAC Name4-ethenyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
SMILESC=Cc1cc(C(F)(F)F)[nH]c(=O)c1C(N)=O
InChIInChI=1S/C9H7F3N2O2/c1-2-4-3-5(9(10,11)12)14-8(16)6(4)7(13)15/h2-3H,1H2,(H2,13,15)(H,14,16)
InChIKeyAZGLLCFHRIMZFA-UHFFFAOYSA-N
XLogP1.14
TPSA75.95 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.16
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The IUPAC name of 4-ethenyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide (CID 170699866) is 4-ethenyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide.
What is the SMILES notation for 4-ethenyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The canonical SMILES for 4-ethenyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide is C=Cc1cc(C(F)(F)F)[nH]c(=O)c1C(N)=O.
What is the InChIKey of 4-ethenyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The InChIKey is AZGLLCFHRIMZFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7F3N2O2/c1-2-4-3-5(9(10,11)12)14-8(16)6(4)7(13)15/h2-3H,1H2,(H2,13,15)(H,14,16).
What are the key properties of 4-ethenyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
4-ethenyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide has a molecular weight of 232.16 g/mol, XLogP of 1.14, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide is sourced from PubChem (CID 170699866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).