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

C8H8F2N2O3 — CID 118834252

IUPAC4-(difluoromethyl)-2-methoxy-6-oxo-1H-pyridine-3-carboxamide
SMILESCOc1[nH]c(=O)cc(C(F)F)c1C(N)=O
InChIInChI=1S/C8H8F2N2O3/c1-15-8-5(7(11)14)3(6(9)10)2-4(13)12-8/h2,6H,1H3,(H2,11,14)(H,12,13)
InChIKeyLJWVSJPRMCLKJN-UHFFFAOYSA-N
MW218.16 g/mol
LogP0.42
Rot. Bonds3

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

4-(difluoromethyl)-2-methoxy-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 118834252) has the molecular formula C8H8F2N2O3 and a molecular weight of 218.16 g/mol. Its IUPAC name is 4-(difluoromethyl)-2-methoxy-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name4-(difluoromethyl)-2-methoxy-6-oxo-1H-pyridine-3-carboxamide
PubChem CID118834252
Molecular FormulaC8H8F2N2O3
Molecular Weight218.16 g/mol
Exact Mass218.05
IUPAC Name4-(difluoromethyl)-2-methoxy-6-oxo-1H-pyridine-3-carboxamide
SMILESCOc1[nH]c(=O)cc(C(F)F)c1C(N)=O
InChIInChI=1S/C8H8F2N2O3/c1-15-8-5(7(11)14)3(6(9)10)2-4(13)12-8/h2,6H,1H3,(H2,11,14)(H,12,13)
InChIKeyLJWVSJPRMCLKJN-UHFFFAOYSA-N
XLogP0.42
TPSA85.18 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.16
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,6-Dihydroxy-4-(trifluoromethyl)nicotinamide
CID 122360887
4-(aminomethyl)-5-methyl-6-(trifluoromethoxy)-1H-pyridin-2-one
CID 118801085
2-(4-(Difluoromethyl)-2-hydroxy-6-methoxypyridin-3-yl)acetonitrile
CID 118801176
4-(Difluoromethyl)-6-methoxy-5-methylpyridin-2-ol
CID 118801364
4-(Difluoromethyl)-6-methoxy-5-(trifluoromethyl)pyridin-2-ol
CID 118811657
4-(Aminomethyl)-5-(difluoromethyl)-6-methoxypyridin-2-ol
CID 118817886
4-(aminomethyl)-6-oxo-2-(trifluoromethoxy)-1H-pyridine-3-carbaldehyde
CID 118818590
4-(Difluoromethyl)-2,6-dihydroxynicotinamide
CID 118818692
4-(Difluoromethyl)-6-hydroxy-2-methoxynicotinaldehyde
CID 118828577
4-(fluoromethyl)-6-oxo-2-(trifluoromethoxy)-1H-pyridine-3-carbaldehyde
CID 118828993
4-Amino-5-(difluoromethyl)-6-methoxypyridin-2-ol
CID 118829356
4-(Difluoromethyl)-2-fluoro-6-hydroxynicotinamide
CID 118829561

Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethyl)-2-methoxy-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 4-(difluoromethyl)-2-methoxy-6-oxo-1H-pyridine-3-carboxamide (CID 118834252) is 4-(difluoromethyl)-2-methoxy-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 4-(difluoromethyl)-2-methoxy-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 4-(difluoromethyl)-2-methoxy-6-oxo-1H-pyridine-3-carboxamide is COc1[nH]c(=O)cc(C(F)F)c1C(N)=O.
What is the InChIKey of 4-(difluoromethyl)-2-methoxy-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is LJWVSJPRMCLKJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F2N2O3/c1-15-8-5(7(11)14)3(6(9)10)2-4(13)12-8/h2,6H,1H3,(H2,11,14)(H,12,13).
What are the key properties of 4-(difluoromethyl)-2-methoxy-6-oxo-1H-pyridine-3-carboxamide?
4-(difluoromethyl)-2-methoxy-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 218.16 g/mol, XLogP of 0.42, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethyl)-2-methoxy-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 118834252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).