2,4-dimethylpyridazin-3-one;ethane

C8H14N2O — CID 145471849

IUPAC2,4-dimethylpyridazin-3-one;ethane
SMILESCC.Cc1ccnn(C)c1=O
InChIInChI=1S/C6H8N2O.C2H6/c1-5-3-4-7-8(2)6(5)9;1-2/h3-4H,1-2H3;1-2H3
InChIKeyGWUZLVGAZDXVHC-UHFFFAOYSA-N
MW154.21 g/mol
LogP1.11
Rot. Bonds

About 2,4-dimethylpyridazin-3-one;ethane

2,4-dimethylpyridazin-3-one;ethane (PubChem CID 145471849) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is 2,4-dimethylpyridazin-3-one;ethane.

Molecular Properties

Compound Name2,4-dimethylpyridazin-3-one;ethane
PubChem CID145471849
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name2,4-dimethylpyridazin-3-one;ethane
SMILESCC.Cc1ccnn(C)c1=O
InChIInChI=1S/C6H8N2O.C2H6/c1-5-3-4-7-8(2)6(5)9;1-2/h3-4H,1-2H3;1-2H3
InChIKeyGWUZLVGAZDXVHC-UHFFFAOYSA-N
XLogP1.11
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 51.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-amino-4-methylphenyl)-2-methylpyridazin-3-one
CID 58128682
N-(2-methyl-3-oxopyridazin-4-yl)methanesulfonamide
CID 90974866
butane;1,5-dimethylpyrazole;ethane
CID 142280941
potassium;ethane;5-methanidyl-1-methylpyrazole
CID 168886723
4-methylimidazo[1,5-b]pyridazine
CID 57010860
5-(bromomethyl)-1-methylpyrazole
CID 59589503
ethane;(2-methylpyrazol-3-yl)methanol
CID 144625468
(2-methylpyrazol-3-yl)-(2,4,6-trimethylphenyl)methanone
CID 114972636
methanol;2-methylpyrazole-3-carbaldehyde
CID 143813492
1-(2-methylpyrazol-3-yl)ethanone;hydrobromide
CID 140678632
5-(2,4-dimethylphenyl)-1-methylpyrazole
CID 91605877
1-methyl-5-(4-methylthiophen-3-yl)pyrazole
CID 89104490

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethylpyridazin-3-one;ethane?
The IUPAC name of 2,4-dimethylpyridazin-3-one;ethane (CID 145471849) is 2,4-dimethylpyridazin-3-one;ethane.
What is the SMILES notation for 2,4-dimethylpyridazin-3-one;ethane?
The canonical SMILES for 2,4-dimethylpyridazin-3-one;ethane is CC.Cc1ccnn(C)c1=O.
What is the InChIKey of 2,4-dimethylpyridazin-3-one;ethane?
The InChIKey is GWUZLVGAZDXVHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O.C2H6/c1-5-3-4-7-8(2)6(5)9;1-2/h3-4H,1-2H3;1-2H3.
What are the key properties of 2,4-dimethylpyridazin-3-one;ethane?
2,4-dimethylpyridazin-3-one;ethane has a molecular weight of 154.21 g/mol, XLogP of 1.11, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethylpyridazin-3-one;ethane is sourced from PubChem (CID 145471849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).