3-cyclohexyl-4H-pyridazin-5-one

C10H14N2O — CID 55268563

IUPAC3-cyclohexyl-4H-pyridazin-5-one
SMILESO=C1C=NN=C(C2CCCCC2)C1
InChIInChI=1S/C10H14N2O/c13-9-6-10(12-11-7-9)8-4-2-1-3-5-8/h7-8H,1-6H2
InChIKeyCFWLUVJDTMIPOU-UHFFFAOYSA-N
MW178.24 g/mol
LogP1.97
Rot. Bonds1

About 3-cyclohexyl-4H-pyridazin-5-one

3-cyclohexyl-4H-pyridazin-5-one (PubChem CID 55268563) has the molecular formula C10H14N2O and a molecular weight of 178.24 g/mol. Its IUPAC name is 3-cyclohexyl-4H-pyridazin-5-one.

Molecular Properties

Compound Name3-cyclohexyl-4H-pyridazin-5-one
PubChem CID55268563
Molecular FormulaC10H14N2O
Molecular Weight178.24 g/mol
Exact Mass178.11
IUPAC Name3-cyclohexyl-4H-pyridazin-5-one
SMILESO=C1C=NN=C(C2CCCCC2)C1
InChIInChI=1S/C10H14N2O/c13-9-6-10(12-11-7-9)8-4-2-1-3-5-8/h7-8H,1-6H2
InChIKeyCFWLUVJDTMIPOU-UHFFFAOYSA-N
XLogP1.97
TPSA41.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-cyclohexyl-4H-pyridazin-5-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 3-cyclohexyl-4H-pyridazin-5-one?
The IUPAC name of 3-cyclohexyl-4H-pyridazin-5-one (CID 55268563) is 3-cyclohexyl-4H-pyridazin-5-one.
What is the SMILES notation for 3-cyclohexyl-4H-pyridazin-5-one?
The canonical SMILES for 3-cyclohexyl-4H-pyridazin-5-one is O=C1C=NN=C(C2CCCCC2)C1.
What is the InChIKey of 3-cyclohexyl-4H-pyridazin-5-one?
The InChIKey is CFWLUVJDTMIPOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c13-9-6-10(12-11-7-9)8-4-2-1-3-5-8/h7-8H,1-6H2.
What are the key properties of 3-cyclohexyl-4H-pyridazin-5-one?
3-cyclohexyl-4H-pyridazin-5-one has a molecular weight of 178.24 g/mol, XLogP of 1.97, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-4H-pyridazin-5-one is sourced from PubChem (CID 55268563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).