N-[6-(difluoromethyl)-2-oxo-1H-pyridin-3-yl]formamide

C7H6F2N2O2 — CID 174589451

IUPACN-[6-(difluoromethyl)-2-oxo-1H-pyridin-3-yl]formamide
SMILESO=CNc1ccc(C(F)F)[nH]c1=O
InChIInChI=1S/C7H6F2N2O2/c8-6(9)4-1-2-5(10-3-12)7(13)11-4/h1-3,6H,(H,10,12)(H,11,13)
InChIKeyNZUXWUCFNXGNCK-UHFFFAOYSA-N
MW188.13 g/mol
LogP0.88
Rot. Bonds3

About N-[6-(difluoromethyl)-2-oxo-1H-pyridin-3-yl]formamide

N-[6-(difluoromethyl)-2-oxo-1H-pyridin-3-yl]formamide (PubChem CID 174589451) has the molecular formula C7H6F2N2O2 and a molecular weight of 188.13 g/mol. Its IUPAC name is N-[6-(difluoromethyl)-2-oxo-1H-pyridin-3-yl]formamide.

Molecular Properties

Compound NameN-[6-(difluoromethyl)-2-oxo-1H-pyridin-3-yl]formamide
PubChem CID174589451
Molecular FormulaC7H6F2N2O2
Molecular Weight188.13 g/mol
Exact Mass188.04
IUPAC NameN-[6-(difluoromethyl)-2-oxo-1H-pyridin-3-yl]formamide
SMILESO=CNc1ccc(C(F)F)[nH]c1=O
InChIInChI=1S/C7H6F2N2O2/c8-6(9)4-1-2-5(10-3-12)7(13)11-4/h1-3,6H,(H,10,12)(H,11,13)
InChIKeyNZUXWUCFNXGNCK-UHFFFAOYSA-N
XLogP0.88
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.13
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2,2,2-trifluoro-N-(2-hydroxypyridin-3-yl)acetamide
CID 18672177
N-[2-oxo-6-(trifluoromethyl)-1H-pyridin-3-yl]acetamide
CID 132019946
1-Methoxy-3-(methylamino)-6-(trifluoromethyl)pyridin-2-one
CID 134466823
N-(5-fluoro-2-oxo-1H-pyridin-3-yl)acetamide
CID 138578529
3-(methylamino)-6-(trifluoromethyl)-1H-pyridin-2-one
CID 154403426
3-(2,2,2-trifluoroethylamino)-1H-pyridin-2-one
CID 170012444
N-[2-oxo-6-(trifluoromethyl)-1H-pyridin-3-yl]formamide
CID 174589457
N-[5-chloro-2-oxo-6-(trifluoromethyl)-1H-pyridin-3-yl]formamide
CID 174589532
N-[6-(difluoromethyl)-2-oxo-1-propan-2-yl-3-pyridinyl]formamide
CID 174604341
5-fluoro-N-methyl-6-oxo-1H-pyridine-2-carboxamide
CID 175836342
2-(3-amino-2-oxo-1-pyridinyl)-N-(2,2,2-trifluoroethyl)acetamide
CID 55035707
2-(5-amino-2-oxo-1-pyridinyl)-N-(2,2,2-trifluoroethyl)acetamide
CID 61492443

Frequently Asked Questions

What is the IUPAC name of N-[6-(difluoromethyl)-2-oxo-1H-pyridin-3-yl]formamide?
The IUPAC name of N-[6-(difluoromethyl)-2-oxo-1H-pyridin-3-yl]formamide (CID 174589451) is N-[6-(difluoromethyl)-2-oxo-1H-pyridin-3-yl]formamide.
What is the SMILES notation for N-[6-(difluoromethyl)-2-oxo-1H-pyridin-3-yl]formamide?
The canonical SMILES for N-[6-(difluoromethyl)-2-oxo-1H-pyridin-3-yl]formamide is O=CNc1ccc(C(F)F)[nH]c1=O.
What is the InChIKey of N-[6-(difluoromethyl)-2-oxo-1H-pyridin-3-yl]formamide?
The InChIKey is NZUXWUCFNXGNCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F2N2O2/c8-6(9)4-1-2-5(10-3-12)7(13)11-4/h1-3,6H,(H,10,12)(H,11,13).
What are the key properties of N-[6-(difluoromethyl)-2-oxo-1H-pyridin-3-yl]formamide?
N-[6-(difluoromethyl)-2-oxo-1H-pyridin-3-yl]formamide has a molecular weight of 188.13 g/mol, XLogP of 0.88, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(difluoromethyl)-2-oxo-1H-pyridin-3-yl]formamide is sourced from PubChem (CID 174589451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).