indeno[1,2-c]pyridazin-5-one

C11H6N2O — CID 23273810

IUPACindeno[1,2-c]pyridazin-5-one
SMILESO=C1c2ccccc2-c2nnccc21
InChIInChI=1S/C11H6N2O/c14-11-8-4-2-1-3-7(8)10-9(11)5-6-12-13-10/h1-6H
InChIKeyMNGSKNUHZZSDIM-UHFFFAOYSA-N
MW182.18 g/mol
LogP1.69
Rot. Bonds

About indeno[1,2-c]pyridazin-5-one

indeno[1,2-c]pyridazin-5-one (PubChem CID 23273810) has the molecular formula C11H6N2O and a molecular weight of 182.18 g/mol. Its IUPAC name is indeno[1,2-c]pyridazin-5-one.

Molecular Properties

Compound Nameindeno[1,2-c]pyridazin-5-one
PubChem CID23273810
Molecular FormulaC11H6N2O
Molecular Weight182.18 g/mol
Exact Mass182.05
IUPAC Nameindeno[1,2-c]pyridazin-5-one
SMILESO=C1c2ccccc2-c2nnccc21
InChIInChI=1S/C11H6N2O/c14-11-8-4-2-1-3-7(8)10-9(11)5-6-12-13-10/h1-6H
InChIKeyMNGSKNUHZZSDIM-UHFFFAOYSA-N
XLogP1.69
TPSA42.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.18
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'keto_phenone_A(11)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of indeno[1,2-c]pyridazin-5-one?
The IUPAC name of indeno[1,2-c]pyridazin-5-one (CID 23273810) is indeno[1,2-c]pyridazin-5-one.
What is the SMILES notation for indeno[1,2-c]pyridazin-5-one?
The canonical SMILES for indeno[1,2-c]pyridazin-5-one is O=C1c2ccccc2-c2nnccc21.
What is the InChIKey of indeno[1,2-c]pyridazin-5-one?
The InChIKey is MNGSKNUHZZSDIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6N2O/c14-11-8-4-2-1-3-7(8)10-9(11)5-6-12-13-10/h1-6H.
What are the key properties of indeno[1,2-c]pyridazin-5-one?
indeno[1,2-c]pyridazin-5-one has a molecular weight of 182.18 g/mol, XLogP of 1.69, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for indeno[1,2-c]pyridazin-5-one is sourced from PubChem (CID 23273810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).