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

C7H5F3N2O2 — CID 118817665

IUPAC4-(difluoromethyl)-3-fluoro-6-oxo-1H-pyridine-2-carboxamide
SMILESNC(=O)c1[nH]c(=O)cc(C(F)F)c1F
InChIInChI=1S/C7H5F3N2O2/c8-4-2(6(9)10)1-3(13)12-5(4)7(11)14/h1,6H,(H2,11,14)(H,12,13)
InChIKeySBABWBFVAQABLW-UHFFFAOYSA-N
MW206.12 g/mol
LogP0.55
Rot. Bonds2

About 4-(difluoromethyl)-3-fluoro-6-oxo-1H-pyridine-2-carboxamide

4-(difluoromethyl)-3-fluoro-6-oxo-1H-pyridine-2-carboxamide (PubChem CID 118817665) has the molecular formula C7H5F3N2O2 and a molecular weight of 206.12 g/mol. Its IUPAC name is 4-(difluoromethyl)-3-fluoro-6-oxo-1H-pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(difluoromethyl)-3-fluoro-6-oxo-1H-pyridine-2-carboxamide
PubChem CID118817665
Molecular FormulaC7H5F3N2O2
Molecular Weight206.12 g/mol
Exact Mass206.03
IUPAC Name4-(difluoromethyl)-3-fluoro-6-oxo-1H-pyridine-2-carboxamide
SMILESNC(=O)c1[nH]c(=O)cc(C(F)F)c1F
InChIInChI=1S/C7H5F3N2O2/c8-4-2(6(9)10)1-3(13)12-5(4)7(11)14/h1,6H,(H2,11,14)(H,12,13)
InChIKeySBABWBFVAQABLW-UHFFFAOYSA-N
XLogP0.55
TPSA75.95 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.12
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-Methyl-4-(trifluoromethyl)pyridin-2(1H)-one
CID 2782992
4-Methyl-6-(trifluoromethyl)pyridin-2(1H)-one
CID 10035141
6-Hydroxy-4-(trifluoromethyl)picolinaldehyde
CID 57557587
6-methyl-3-(methylamino)-4-(trifluoromethyl)-1H-pyridin-2-one
CID 123165121
5-Amino-6-oxo-3-(trifluoromethyl)-1,6-dihydropyridine-2-carbonitrile
CID 141138151
N-(4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)acetamide
CID 586682
2-(Difluoromethyl)-6-hydroxy-4-methylpyridine
CID 10103416
6-(Aminomethyl)-4-(trifluoromethyl)pyridin-2-OL
CID 72216096
6-[6-oxo-4-(trifluoromethyl)-1H-pyridin-2-yl]-4-(trifluoromethyl)-1H-pyridin-2-one
CID 102133696
6-(aminomethyl)-5-(trifluoromethyl)-1H-pyridin-2-one
CID 105445627
3-Amino-4,6-dimethyl-1-(trifluoromethyl)pyridin-2-one
CID 105458340
4-Amino-3-(difluoromethyl)-6-hydroxypicolinaldehyde
CID 118800888

Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethyl)-3-fluoro-6-oxo-1H-pyridine-2-carboxamide?
The IUPAC name of 4-(difluoromethyl)-3-fluoro-6-oxo-1H-pyridine-2-carboxamide (CID 118817665) is 4-(difluoromethyl)-3-fluoro-6-oxo-1H-pyridine-2-carboxamide.
What is the SMILES notation for 4-(difluoromethyl)-3-fluoro-6-oxo-1H-pyridine-2-carboxamide?
The canonical SMILES for 4-(difluoromethyl)-3-fluoro-6-oxo-1H-pyridine-2-carboxamide is NC(=O)c1[nH]c(=O)cc(C(F)F)c1F.
What is the InChIKey of 4-(difluoromethyl)-3-fluoro-6-oxo-1H-pyridine-2-carboxamide?
The InChIKey is SBABWBFVAQABLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F3N2O2/c8-4-2(6(9)10)1-3(13)12-5(4)7(11)14/h1,6H,(H2,11,14)(H,12,13).
What are the key properties of 4-(difluoromethyl)-3-fluoro-6-oxo-1H-pyridine-2-carboxamide?
4-(difluoromethyl)-3-fluoro-6-oxo-1H-pyridine-2-carboxamide has a molecular weight of 206.12 g/mol, XLogP of 0.55, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethyl)-3-fluoro-6-oxo-1H-pyridine-2-carboxamide is sourced from PubChem (CID 118817665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).