4-(cyclobutylmethoxy)-1H-pyridazin-6-one

C9H12N2O2 — CID 71607380

IUPAC4-(cyclobutylmethoxy)-1H-pyridazin-6-one
SMILESO=c1cc(OCC2CCC2)cn[nH]1
InChIInChI=1S/C9H12N2O2/c12-9-4-8(5-10-11-9)13-6-7-2-1-3-7/h4-5,7H,1-3,6H2,(H,11,12)
InChIKeyYOAYXADILZTHQN-UHFFFAOYSA-N
MW180.21 g/mol
LogP0.95
Rot. Bonds3

About 4-(cyclobutylmethoxy)-1H-pyridazin-6-one

4-(cyclobutylmethoxy)-1H-pyridazin-6-one (PubChem CID 71607380) has the molecular formula C9H12N2O2 and a molecular weight of 180.21 g/mol. Its IUPAC name is 4-(cyclobutylmethoxy)-1H-pyridazin-6-one.

Molecular Properties

Compound Name4-(cyclobutylmethoxy)-1H-pyridazin-6-one
PubChem CID71607380
Molecular FormulaC9H12N2O2
Molecular Weight180.21 g/mol
Exact Mass180.09
IUPAC Name4-(cyclobutylmethoxy)-1H-pyridazin-6-one
SMILESO=c1cc(OCC2CCC2)cn[nH]1
InChIInChI=1S/C9H12N2O2/c12-9-4-8(5-10-11-9)13-6-7-2-1-3-7/h4-5,7H,1-3,6H2,(H,11,12)
InChIKeyYOAYXADILZTHQN-UHFFFAOYSA-N
XLogP0.95
TPSA54.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(cyclobutylmethoxy)-1H-pyridazin-6-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 4-(cyclobutylmethoxy)-1H-pyridazin-6-one?
The IUPAC name of 4-(cyclobutylmethoxy)-1H-pyridazin-6-one (CID 71607380) is 4-(cyclobutylmethoxy)-1H-pyridazin-6-one.
What is the SMILES notation for 4-(cyclobutylmethoxy)-1H-pyridazin-6-one?
The canonical SMILES for 4-(cyclobutylmethoxy)-1H-pyridazin-6-one is O=c1cc(OCC2CCC2)cn[nH]1.
What is the InChIKey of 4-(cyclobutylmethoxy)-1H-pyridazin-6-one?
The InChIKey is YOAYXADILZTHQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O2/c12-9-4-8(5-10-11-9)13-6-7-2-1-3-7/h4-5,7H,1-3,6H2,(H,11,12).
What are the key properties of 4-(cyclobutylmethoxy)-1H-pyridazin-6-one?
4-(cyclobutylmethoxy)-1H-pyridazin-6-one has a molecular weight of 180.21 g/mol, XLogP of 0.95, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclobutylmethoxy)-1H-pyridazin-6-one is sourced from PubChem (CID 71607380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).