7,8-dimethoxy-2,5-dihydroindeno[1,2-c]pyridazin-3-one

C13H12N2O3 — CID 10421909

IUPAC7,8-dimethoxy-2,5-dihydroindeno[1,2-c]pyridazin-3-one
SMILESCOc1cc2c(cc1OC)-c1n[nH]c(=O)cc1C2
InChIInChI=1S/C13H12N2O3/c1-17-10-4-7-3-8-5-12(16)14-15-13(8)9(7)6-11(10)18-2/h4-6H,3H2,1-2H3,(H,14,16)
InChIKeyOMMMFPPVKIEEKW-UHFFFAOYSA-N
MW244.25 g/mol
LogP1.36
Rot. Bonds2

About 7,8-dimethoxy-2,5-dihydroindeno[1,2-c]pyridazin-3-one

7,8-dimethoxy-2,5-dihydroindeno[1,2-c]pyridazin-3-one (PubChem CID 10421909) has the molecular formula C13H12N2O3 and a molecular weight of 244.25 g/mol. Its IUPAC name is 7,8-dimethoxy-2,5-dihydroindeno[1,2-c]pyridazin-3-one.

Molecular Properties

Compound Name7,8-dimethoxy-2,5-dihydroindeno[1,2-c]pyridazin-3-one
PubChem CID10421909
Molecular FormulaC13H12N2O3
Molecular Weight244.25 g/mol
Exact Mass244.08
IUPAC Name7,8-dimethoxy-2,5-dihydroindeno[1,2-c]pyridazin-3-one
SMILESCOc1cc2c(cc1OC)-c1n[nH]c(=O)cc1C2
InChIInChI=1S/C13H12N2O3/c1-17-10-4-7-3-8-5-12(16)14-15-13(8)9(7)6-11(10)18-2/h4-6H,3H2,1-2H3,(H,14,16)
InChIKeyOMMMFPPVKIEEKW-UHFFFAOYSA-N
XLogP1.36
TPSA64.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.25
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 7,8-dimethoxy-2,5-dihydroindeno[1,2-c]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 7,8-dimethoxy-2,5-dihydroindeno[1,2-c]pyridazin-3-one?
The IUPAC name of 7,8-dimethoxy-2,5-dihydroindeno[1,2-c]pyridazin-3-one (CID 10421909) is 7,8-dimethoxy-2,5-dihydroindeno[1,2-c]pyridazin-3-one.
What is the SMILES notation for 7,8-dimethoxy-2,5-dihydroindeno[1,2-c]pyridazin-3-one?
The canonical SMILES for 7,8-dimethoxy-2,5-dihydroindeno[1,2-c]pyridazin-3-one is COc1cc2c(cc1OC)-c1n[nH]c(=O)cc1C2.
What is the InChIKey of 7,8-dimethoxy-2,5-dihydroindeno[1,2-c]pyridazin-3-one?
The InChIKey is OMMMFPPVKIEEKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O3/c1-17-10-4-7-3-8-5-12(16)14-15-13(8)9(7)6-11(10)18-2/h4-6H,3H2,1-2H3,(H,14,16).
What are the key properties of 7,8-dimethoxy-2,5-dihydroindeno[1,2-c]pyridazin-3-one?
7,8-dimethoxy-2,5-dihydroindeno[1,2-c]pyridazin-3-one has a molecular weight of 244.25 g/mol, XLogP of 1.36, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-dimethoxy-2,5-dihydroindeno[1,2-c]pyridazin-3-one is sourced from PubChem (CID 10421909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).