5-ethyl-2,6-dimethylpyridazin-3-one

C8H12N2O — CID 172614406

IUPAC5-ethyl-2,6-dimethylpyridazin-3-one
SMILESCCc1cc(=O)n(C)nc1C
InChIInChI=1S/C8H12N2O/c1-4-7-5-8(11)10(3)9-6(7)2/h5H,4H2,1-3H3
InChIKeyLIWZWMRIZXJSRE-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.65
Rot. Bonds1

About 5-ethyl-2,6-dimethylpyridazin-3-one

5-ethyl-2,6-dimethylpyridazin-3-one (PubChem CID 172614406) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is 5-ethyl-2,6-dimethylpyridazin-3-one.

Molecular Properties

Compound Name5-ethyl-2,6-dimethylpyridazin-3-one
PubChem CID172614406
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name5-ethyl-2,6-dimethylpyridazin-3-one
SMILESCCc1cc(=O)n(C)nc1C
InChIInChI=1S/C8H12N2O/c1-4-7-5-8(11)10(3)9-6(7)2/h5H,4H2,1-3H3
InChIKeyLIWZWMRIZXJSRE-UHFFFAOYSA-N
XLogP0.65
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-Methyl-3(2H)-cinnolinone
CID 368585
2,6-dimethylpyridazin-3(2H)-one
CID 12200174
2,6-Dimethyl-5-(trifluoromethyl)pyridazin-3-one
CID 138715792
2,4-Dimethyl-6-(trifluoromethyl)pyridazin-3-one;ethane
CID 142521701
2-Methyl-6-propan-2-yl-5-(trifluoromethyl)pyridazin-3-one
CID 162773660
6-Fluoro-2-methyl-5-propan-2-ylpyridazin-3-one
CID 172614571
2-Methyl-5,8-dihydropyrido[4,3-c]pyridazin-3-one
CID 155921266
2,4,5,6-Tetramethylpyridazin-3-one
CID 18683336
6-Tert-butyl-2,4-dimethylpyridazin-3-one
CID 58499036
2,4,6-Trimethylpyridazin-3-one
CID 58694571
2-Methyl-6-propan-2-ylpyridazin-3-one
CID 58757207
4-Ethyl-2,6-dimethylpyridazin-3-one
CID 59120442

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2,6-dimethylpyridazin-3-one?
The IUPAC name of 5-ethyl-2,6-dimethylpyridazin-3-one (CID 172614406) is 5-ethyl-2,6-dimethylpyridazin-3-one.
What is the SMILES notation for 5-ethyl-2,6-dimethylpyridazin-3-one?
The canonical SMILES for 5-ethyl-2,6-dimethylpyridazin-3-one is CCc1cc(=O)n(C)nc1C.
What is the InChIKey of 5-ethyl-2,6-dimethylpyridazin-3-one?
The InChIKey is LIWZWMRIZXJSRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c1-4-7-5-8(11)10(3)9-6(7)2/h5H,4H2,1-3H3.
What are the key properties of 5-ethyl-2,6-dimethylpyridazin-3-one?
5-ethyl-2,6-dimethylpyridazin-3-one has a molecular weight of 152.20 g/mol, XLogP of 0.65, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2,6-dimethylpyridazin-3-one is sourced from PubChem (CID 172614406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).