3-cyclobutyl-1H-pyridazin-6-one

C8H10N2O — CID 53402961

IUPAC3-cyclobutyl-1H-pyridazin-6-one
SMILESO=c1ccc(C2CCC2)n[nH]1
InChIInChI=1S/C8H10N2O/c11-8-5-4-7(9-10-8)6-2-1-3-6/h4-6H,1-3H2,(H,10,11)
InChIKeyZJJALKGGEULFCP-UHFFFAOYSA-N
MW150.18 g/mol
LogP1.04
Rot. Bonds1

About 3-cyclobutyl-1H-pyridazin-6-one

3-cyclobutyl-1H-pyridazin-6-one (PubChem CID 53402961) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is 3-cyclobutyl-1H-pyridazin-6-one.

Molecular Properties

Compound Name3-cyclobutyl-1H-pyridazin-6-one
PubChem CID53402961
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name3-cyclobutyl-1H-pyridazin-6-one
SMILESO=c1ccc(C2CCC2)n[nH]1
InChIInChI=1S/C8H10N2O/c11-8-5-4-7(9-10-8)6-2-1-3-6/h4-6H,1-3H2,(H,10,11)
InChIKeyZJJALKGGEULFCP-UHFFFAOYSA-N
XLogP1.04
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclobutyl-1H-pyridazin-6-one?
The IUPAC name of 3-cyclobutyl-1H-pyridazin-6-one (CID 53402961) is 3-cyclobutyl-1H-pyridazin-6-one.
What is the SMILES notation for 3-cyclobutyl-1H-pyridazin-6-one?
The canonical SMILES for 3-cyclobutyl-1H-pyridazin-6-one is O=c1ccc(C2CCC2)n[nH]1.
What is the InChIKey of 3-cyclobutyl-1H-pyridazin-6-one?
The InChIKey is ZJJALKGGEULFCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c11-8-5-4-7(9-10-8)6-2-1-3-6/h4-6H,1-3H2,(H,10,11).
What are the key properties of 3-cyclobutyl-1H-pyridazin-6-one?
3-cyclobutyl-1H-pyridazin-6-one has a molecular weight of 150.18 g/mol, XLogP of 1.04, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutyl-1H-pyridazin-6-one is sourced from PubChem (CID 53402961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).