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

C7H6F2N2O2 — CID 130097263

IUPAC5-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESNC(=O)c1cc(C(F)F)c[nH]c1=O
InChIInChI=1S/C7H6F2N2O2/c8-5(9)3-1-4(6(10)12)7(13)11-2-3/h1-2,5H,(H2,10,12)(H,11,13)
InChIKeyPNBLICCFESZCRT-UHFFFAOYSA-N
MW188.13 g/mol
LogP0.41
Rot. Bonds2

About 5-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide

5-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 130097263) has the molecular formula C7H6F2N2O2 and a molecular weight of 188.13 g/mol. Its IUPAC name is 5-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide
PubChem CID130097263
Molecular FormulaC7H6F2N2O2
Molecular Weight188.13 g/mol
Exact Mass188.04
IUPAC Name5-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESNC(=O)c1cc(C(F)F)c[nH]c1=O
InChIInChI=1S/C7H6F2N2O2/c8-5(9)3-1-4(6(10)12)7(13)11-2-3/h1-2,5H,(H2,10,12)(H,11,13)
InChIKeyPNBLICCFESZCRT-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 5-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 5-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide (CID 130097263) is 5-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 5-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 5-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide is NC(=O)c1cc(C(F)F)c[nH]c1=O.
What is the InChIKey of 5-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is PNBLICCFESZCRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F2N2O2/c8-5(9)3-1-4(6(10)12)7(13)11-2-3/h1-2,5H,(H2,10,12)(H,11,13).
What are the key properties of 5-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide?
5-(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 5-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 130097263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).