2,4-dimethylpyridazin-3-one;ethane

C10H20N2O — CID 145471918

IUPAC2,4-dimethylpyridazin-3-one;ethane
SMILESCC.CC.Cc1ccnn(C)c1=O
InChIInChI=1S/C6H8N2O.2C2H6/c1-5-3-4-7-8(2)6(5)9;2*1-2/h3-4H,1-2H3;2*1-2H3
InChIKeyJTUWDCCLUYJPRS-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.14
Rot. Bonds

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

2,4-dimethylpyridazin-3-one;ethane (PubChem CID 145471918) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 2,4-dimethylpyridazin-3-one;ethane.

Molecular Properties

Compound Name2,4-dimethylpyridazin-3-one;ethane
PubChem CID145471918
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name2,4-dimethylpyridazin-3-one;ethane
SMILESCC.CC.Cc1ccnn(C)c1=O
InChIInChI=1S/C6H8N2O.2C2H6/c1-5-3-4-7-8(2)6(5)9;2*1-2/h3-4H,1-2H3;2*1-2H3
InChIKeyJTUWDCCLUYJPRS-UHFFFAOYSA-N
XLogP2.14
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-Methylpyridazin-3(2H)-one
CID 12200169
2,5-Dimethyl-2,3-dihydropyridazin-3-one
CID 12200173
2-Butylpyridazin-3-one
CID 12758395
2-Methyl-3-oxo-2,3-dihydropyridazine-4-carbonitrile
CID 13896255
2,4,5-Trimethylpyridazin-3-one
CID 20669839
2,4-Dimethylpyridazin-3(2H)-one
CID 20772174
2-Propylpyridazin-3-one
CID 21479118
4-(Aminomethyl)-2-(2-methylpropyl)pyridazin-3-one
CID 23018232
2-(2-Methylpropyl)pyridazin-3-one
CID 23018253
4-(Aminomethyl)-2-(2-methylpropyl)pyridazin-3-one;hydrochloride
CID 23018258
4-(Aminomethyl)-2-methylpyridazin-3-one
CID 55285531
2-[2-(Dimethylamino)ethyl]-4-methylpyridazin-3-one
CID 57584072

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 145471918) 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.CC.Cc1ccnn(C)c1=O.
What is the InChIKey of 2,4-dimethylpyridazin-3-one;ethane?
The InChIKey is JTUWDCCLUYJPRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O.2C2H6/c1-5-3-4-7-8(2)6(5)9;2*1-2/h3-4H,1-2H3;2*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 184.28 g/mol, XLogP of 2.14, 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 145471918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).