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

C7H6F2N2O2 — CID 130097255

IUPAC5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide
SMILESNC(=O)c1ccc(C(F)F)c(=O)[nH]1
InChIInChI=1S/C7H6F2N2O2/c8-5(9)3-1-2-4(6(10)12)11-7(3)13/h1-2,5H,(H2,10,12)(H,11,13)
InChIKeyIRMVNLPSQXMCOG-UHFFFAOYSA-N
MW188.13 g/mol
LogP0.41
Rot. Bonds2

About 5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide

5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide (PubChem CID 130097255) has the molecular formula C7H6F2N2O2 and a molecular weight of 188.13 g/mol. Its IUPAC name is 5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide
PubChem CID130097255
Molecular FormulaC7H6F2N2O2
Molecular Weight188.13 g/mol
Exact Mass188.04
IUPAC Name5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide
SMILESNC(=O)c1ccc(C(F)F)c(=O)[nH]1
InChIInChI=1S/C7H6F2N2O2/c8-5(9)3-1-2-4(6(10)12)11-7(3)13/h1-2,5H,(H2,10,12)(H,11,13)
InChIKeyIRMVNLPSQXMCOG-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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Related Compounds

2-Hydroxy-6-(trifluoromethyl)nicotinamide
CID 2775114
3-Amino-6-(trifluoromethyl)-1,2-dihydropyridin-2-one hydrochloride
CID 119030935
2(1H)-Pyridinone, 6-methyl-3-(trifluoromethyl)-
CID 20767670
3-Amino-6-(trifluoromethyl)pyridin-2-ol
CID 39871634
3-Methyl-6-(trifluoromethyl)-1,2-dihydropyridin-2-one
CID 59340901
6-(Difluoromethyl)-2-hydroxypyridine-3-carboxamide
CID 59828229
6-Hydroxy-5-(trifluoromethyl)picolinaldehyde
CID 105444637
N-[2-oxo-6-(trifluoromethyl)-1H-pyridin-3-yl]acetamide
CID 132019946
6-methyl-3-(trifluoromethyl)-1H-pyridin-1-ium-2-one
CID 163718252
N-methyl-6-oxo-5-(trifluoromethyl)-1H-pyridine-2-carboxamide
CID 175836289
3-Amino-6-(difluoromethyl)pyridin-2(1H)-one
CID 97181480
6-(aminomethyl)-3-(trifluoromethyl)-1H-pyridin-2-one
CID 105445629

Frequently Asked Questions

What is the IUPAC name of 5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide?
The IUPAC name of 5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide (CID 130097255) is 5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide.
What is the SMILES notation for 5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide?
The canonical SMILES for 5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide is NC(=O)c1ccc(C(F)F)c(=O)[nH]1.
What is the InChIKey of 5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide?
The InChIKey is IRMVNLPSQXMCOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F2N2O2/c8-5(9)3-1-2-4(6(10)12)11-7(3)13/h1-2,5H,(H2,10,12)(H,11,13).
What are the key properties of 5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide?
5-(difluoromethyl)-6-oxo-1H-pyridine-2-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)-6-oxo-1H-pyridine-2-carboxamide is sourced from PubChem (CID 130097255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).