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

C7H4ClF3N2O2 — CID 59828234

IUPAC5-chloro-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
SMILESNC(=O)c1cc(Cl)c(C(F)(F)F)[nH]c1=O
InChIInChI=1S/C7H4ClF3N2O2/c8-3-1-2(5(12)14)6(15)13-4(3)7(9,10)11/h1H,(H2,12,14)(H,13,15)
InChIKeyWCQMQTBQLJWNKY-UHFFFAOYSA-N
MW240.57 g/mol
LogP1.15
Rot. Bonds1

About 5-chloro-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide

5-chloro-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide (PubChem CID 59828234) has the molecular formula C7H4ClF3N2O2 and a molecular weight of 240.57 g/mol. Its IUPAC name is 5-chloro-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
PubChem CID59828234
Molecular FormulaC7H4ClF3N2O2
Molecular Weight240.57 g/mol
Exact Mass239.99
IUPAC Name5-chloro-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
SMILESNC(=O)c1cc(Cl)c(C(F)(F)F)[nH]c1=O
InChIInChI=1S/C7H4ClF3N2O2/c8-3-1-2(5(12)14)6(15)13-4(3)7(9,10)11/h1H,(H2,12,14)(H,13,15)
InChIKeyWCQMQTBQLJWNKY-UHFFFAOYSA-N
XLogP1.15
TPSA75.95 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.57
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The IUPAC name of 5-chloro-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide (CID 59828234) is 5-chloro-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide is NC(=O)c1cc(Cl)c(C(F)(F)F)[nH]c1=O.
What is the InChIKey of 5-chloro-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The InChIKey is WCQMQTBQLJWNKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4ClF3N2O2/c8-3-1-2(5(12)14)6(15)13-4(3)7(9,10)11/h1H,(H2,12,14)(H,13,15).
What are the key properties of 5-chloro-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
5-chloro-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide has a molecular weight of 240.57 g/mol, XLogP of 1.15, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide is sourced from PubChem (CID 59828234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).