4-amino-6-(difluoromethyl)-3-methoxy-1H-pyridin-2-one

C7H8F2N2O2 — CID 118812209

IUPAC4-amino-6-(difluoromethyl)-3-methoxy-1H-pyridin-2-one
SMILESCOc1c(N)cc(C(F)F)[nH]c1=O
InChIInChI=1S/C7H8F2N2O2/c1-13-5-3(10)2-4(6(8)9)11-7(5)12/h2,6H,1H3,(H3,10,11,12)
InChIKeyLYAYEQMILISCBQ-UHFFFAOYSA-N
MW190.15 g/mol
LogP0.90
Rot. Bonds2

About 4-amino-6-(difluoromethyl)-3-methoxy-1H-pyridin-2-one

4-amino-6-(difluoromethyl)-3-methoxy-1H-pyridin-2-one (PubChem CID 118812209) has the molecular formula C7H8F2N2O2 and a molecular weight of 190.15 g/mol. Its IUPAC name is 4-amino-6-(difluoromethyl)-3-methoxy-1H-pyridin-2-one.

Molecular Properties

Compound Name4-amino-6-(difluoromethyl)-3-methoxy-1H-pyridin-2-one
PubChem CID118812209
Molecular FormulaC7H8F2N2O2
Molecular Weight190.15 g/mol
Exact Mass190.06
IUPAC Name4-amino-6-(difluoromethyl)-3-methoxy-1H-pyridin-2-one
SMILESCOc1c(N)cc(C(F)F)[nH]c1=O
InChIInChI=1S/C7H8F2N2O2/c1-13-5-3(10)2-4(6(8)9)11-7(5)12/h2,6H,1H3,(H3,10,11,12)
InChIKeyLYAYEQMILISCBQ-UHFFFAOYSA-N
XLogP0.90
TPSA68.11 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.15
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 6-(difluoromethyl)-3-methoxy-2-oxo-1H-pyridine-4-carboxylate
CID 133103363
4-amino-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxylic acid
CID 118823010
4-amino-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carbonyl chloride
CID 118829139
6-(difluoromethyl)-3-methoxy-4-oxo-1H-pyridine-2-carboxylic acid
CID 130083473
3-chloro-6-(difluoromethyl)-2-methoxy-1H-pyridin-4-one
CID 130072304
6,8-dibromo-2-(difluoromethyl)-5-methoxy-1H-quinolin-4-one
CID 103416536
3-amino-5-(difluoromethyl)-4-methoxy-1H-pyridin-2-one
CID 130104559
6-(difluoromethyl)-4-methyl-2-oxo-1H-pyridine-3-sulfonamide
CID 130084130
6-amino-3-(difluoromethyl)-5-methoxy-1H-pyridin-2-one
CID 130104544
3-bromo-6-(difluoromethyl)-4-methyl-1H-pyridin-2-one
CID 130110117
methyl 2-[3-cyano-6-(difluoromethyl)-2-oxo-1H-pyridin-4-yl]acetate
CID 134686450
3-(difluoromethyl)-5-fluoro-6-methoxy-1H-pyridin-2-one
CID 130079270

Frequently Asked Questions

What is the IUPAC name of 4-amino-6-(difluoromethyl)-3-methoxy-1H-pyridin-2-one?
The IUPAC name of 4-amino-6-(difluoromethyl)-3-methoxy-1H-pyridin-2-one (CID 118812209) is 4-amino-6-(difluoromethyl)-3-methoxy-1H-pyridin-2-one.
What is the SMILES notation for 4-amino-6-(difluoromethyl)-3-methoxy-1H-pyridin-2-one?
The canonical SMILES for 4-amino-6-(difluoromethyl)-3-methoxy-1H-pyridin-2-one is COc1c(N)cc(C(F)F)[nH]c1=O.
What is the InChIKey of 4-amino-6-(difluoromethyl)-3-methoxy-1H-pyridin-2-one?
The InChIKey is LYAYEQMILISCBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F2N2O2/c1-13-5-3(10)2-4(6(8)9)11-7(5)12/h2,6H,1H3,(H3,10,11,12).
What are the key properties of 4-amino-6-(difluoromethyl)-3-methoxy-1H-pyridin-2-one?
4-amino-6-(difluoromethyl)-3-methoxy-1H-pyridin-2-one has a molecular weight of 190.15 g/mol, XLogP of 0.90, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-6-(difluoromethyl)-3-methoxy-1H-pyridin-2-one is sourced from PubChem (CID 118812209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).