4-amino-6-(difluoromethyl)-5-methyl-1H-pyridin-2-one

C7H8F2N2O — CID 118817701

IUPAC4-amino-6-(difluoromethyl)-5-methyl-1H-pyridin-2-one
SMILESCc1c(N)cc(=O)[nH]c1C(F)F
InChIInChI=1S/C7H8F2N2O/c1-3-4(10)2-5(12)11-6(3)7(8)9/h2,7H,1H3,(H3,10,11,12)
InChIKeyGVWCKGZUDKDDQL-UHFFFAOYSA-N
MW174.15 g/mol
LogP1.20
Rot. Bonds1

About 4-amino-6-(difluoromethyl)-5-methyl-1H-pyridin-2-one

4-amino-6-(difluoromethyl)-5-methyl-1H-pyridin-2-one (PubChem CID 118817701) has the molecular formula C7H8F2N2O and a molecular weight of 174.15 g/mol. Its IUPAC name is 4-amino-6-(difluoromethyl)-5-methyl-1H-pyridin-2-one.

Molecular Properties

Compound Name4-amino-6-(difluoromethyl)-5-methyl-1H-pyridin-2-one
PubChem CID118817701
Molecular FormulaC7H8F2N2O
Molecular Weight174.15 g/mol
Exact Mass174.06
IUPAC Name4-amino-6-(difluoromethyl)-5-methyl-1H-pyridin-2-one
SMILESCc1c(N)cc(=O)[nH]c1C(F)F
InChIInChI=1S/C7H8F2N2O/c1-3-4(10)2-5(12)11-6(3)7(8)9/h2,7H,1H3,(H3,10,11,12)
InChIKeyGVWCKGZUDKDDQL-UHFFFAOYSA-N
XLogP1.20
TPSA58.88 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.15
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(difluoromethyl)-3-methyl-6-oxo-1H-pyridine-4-carbaldehyde
CID 118832080
ethyl 4-amino-2-(difluoromethyl)-6-oxo-1H-pyridine-3-carboxylate
CID 133093404
5-amino-4-bromo-6-(difluoromethyl)-1H-pyridin-2-one
CID 130101695
6-(aminomethyl)-4-(difluoromethyl)-5-methyl-1H-pyridin-2-one
CID 118808535
3-amino-2-(difluoromethyl)-6-oxo-1H-pyridine-4-carbonitrile
CID 130103220
4,5-dichloro-6-(difluoromethyl)-1H-pyridin-2-one
CID 130099225
2-(difluoromethyl)-3-methyl-6-(trifluoromethyl)-1H-pyridin-4-one
CID 118825989
4-(aminomethyl)-6-(difluoromethyl)-5-fluoro-1H-pyridin-2-one
CID 130079392
4-(aminomethyl)-6-(difluoromethyl)-5-iodo-1H-pyridin-2-one
CID 130082600
6-(difluoromethyl)-5-fluoro-4-iodo-1H-pyridin-2-one
CID 118826088
2-[3-amino-2-(difluoromethyl)-6-oxo-1H-pyridin-4-yl]acetonitrile
CID 130104803
methyl 2-(difluoromethyl)-4-methyl-6-oxo-1H-pyridine-3-carboxylate
CID 130083978

Frequently Asked Questions

What is the IUPAC name of 4-amino-6-(difluoromethyl)-5-methyl-1H-pyridin-2-one?
The IUPAC name of 4-amino-6-(difluoromethyl)-5-methyl-1H-pyridin-2-one (CID 118817701) is 4-amino-6-(difluoromethyl)-5-methyl-1H-pyridin-2-one.
What is the SMILES notation for 4-amino-6-(difluoromethyl)-5-methyl-1H-pyridin-2-one?
The canonical SMILES for 4-amino-6-(difluoromethyl)-5-methyl-1H-pyridin-2-one is Cc1c(N)cc(=O)[nH]c1C(F)F.
What is the InChIKey of 4-amino-6-(difluoromethyl)-5-methyl-1H-pyridin-2-one?
The InChIKey is GVWCKGZUDKDDQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F2N2O/c1-3-4(10)2-5(12)11-6(3)7(8)9/h2,7H,1H3,(H3,10,11,12).
What are the key properties of 4-amino-6-(difluoromethyl)-5-methyl-1H-pyridin-2-one?
4-amino-6-(difluoromethyl)-5-methyl-1H-pyridin-2-one has a molecular weight of 174.15 g/mol, XLogP of 1.20, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-6-(difluoromethyl)-5-methyl-1H-pyridin-2-one is sourced from PubChem (CID 118817701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).