2-methyl-5-(4-methylpiperazin-1-yl)pyridazin-3-one

C10H16N4O — CID 58484354

IUPAC2-methyl-5-(4-methylpiperazin-1-yl)pyridazin-3-one
SMILESCN1CCN(c2cnn(C)c(=O)c2)CC1
InChIInChI=1S/C10H16N4O/c1-12-3-5-14(6-4-12)9-7-10(15)13(2)11-8-9/h7-8H,3-6H2,1-2H3
InChIKeyLCBKOJSBZPYFNN-UHFFFAOYSA-N
MW208.26 g/mol
LogP-0.47
Rot. Bonds1

About 2-methyl-5-(4-methylpiperazin-1-yl)pyridazin-3-one

2-methyl-5-(4-methylpiperazin-1-yl)pyridazin-3-one (PubChem CID 58484354) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-methyl-5-(4-methylpiperazin-1-yl)pyridazin-3-one.

Molecular Properties

Compound Name2-methyl-5-(4-methylpiperazin-1-yl)pyridazin-3-one
PubChem CID58484354
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name2-methyl-5-(4-methylpiperazin-1-yl)pyridazin-3-one
SMILESCN1CCN(c2cnn(C)c(=O)c2)CC1
InChIInChI=1S/C10H16N4O/c1-12-3-5-14(6-4-12)9-7-10(15)13(2)11-8-9/h7-8H,3-6H2,1-2H3
InChIKeyLCBKOJSBZPYFNN-UHFFFAOYSA-N
XLogP-0.47
TPSA41.37 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 5-0.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-methyl-5-(4-methylpiperazin-1-yl)pyridazin-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(4-methylpiperazin-1-yl)pyridazin-3-one?
The IUPAC name of 2-methyl-5-(4-methylpiperazin-1-yl)pyridazin-3-one (CID 58484354) is 2-methyl-5-(4-methylpiperazin-1-yl)pyridazin-3-one.
What is the SMILES notation for 2-methyl-5-(4-methylpiperazin-1-yl)pyridazin-3-one?
The canonical SMILES for 2-methyl-5-(4-methylpiperazin-1-yl)pyridazin-3-one is CN1CCN(c2cnn(C)c(=O)c2)CC1.
What is the InChIKey of 2-methyl-5-(4-methylpiperazin-1-yl)pyridazin-3-one?
The InChIKey is LCBKOJSBZPYFNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-12-3-5-14(6-4-12)9-7-10(15)13(2)11-8-9/h7-8H,3-6H2,1-2H3.
What are the key properties of 2-methyl-5-(4-methylpiperazin-1-yl)pyridazin-3-one?
2-methyl-5-(4-methylpiperazin-1-yl)pyridazin-3-one has a molecular weight of 208.26 g/mol, XLogP of -0.47, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(4-methylpiperazin-1-yl)pyridazin-3-one is sourced from PubChem (CID 58484354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).