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

C7H6F2N2O2 — CID 59828229

IUPAC6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESNC(=O)c1ccc(C(F)F)[nH]c1=O
InChIInChI=1S/C7H6F2N2O2/c8-5(9)4-2-1-3(6(10)12)7(13)11-4/h1-2,5H,(H2,10,12)(H,11,13)
InChIKeyWKJBZVPXOSOWDB-UHFFFAOYSA-N
MW188.13 g/mol
LogP0.41
Rot. Bonds2

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

6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 59828229) has the molecular formula C7H6F2N2O2 and a molecular weight of 188.13 g/mol. Its IUPAC name is 6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide
PubChem CID59828229
Molecular FormulaC7H6F2N2O2
Molecular Weight188.13 g/mol
Exact Mass188.04
IUPAC Name6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESNC(=O)c1ccc(C(F)F)[nH]c1=O
InChIInChI=1S/C7H6F2N2O2/c8-5(9)4-2-1-3(6(10)12)7(13)11-4/h1-2,5H,(H2,10,12)(H,11,13)
InChIKeyWKJBZVPXOSOWDB-UHFFFAOYSA-N
XLogP0.41
TPSA75.95 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.13
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide (CID 59828229) is 6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide is NC(=O)c1ccc(C(F)F)[nH]c1=O.
What is the InChIKey of 6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is WKJBZVPXOSOWDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F2N2O2/c8-5(9)4-2-1-3(6(10)12)7(13)11-4/h1-2,5H,(H2,10,12)(H,11,13).
What are the key properties of 6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide?
6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 188.13 g/mol, XLogP of 0.41, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 59828229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).