2,4,4a,9-tetrahydroindeno[2,1-c]pyridazin-3-one

C11H10N2O — CID 3063371

IUPAC2,4,4a,9-tetrahydroindeno[2,1-c]pyridazin-3-one
SMILESO=C1CC2C(=NN1)Cc1ccccc12
InChIInChI=1S/C11H10N2O/c14-11-6-9-8-4-2-1-3-7(8)5-10(9)12-13-11/h1-4,9H,5-6H2,(H,13,14)
InChIKeyNSLWKAHYUAHLNR-UHFFFAOYSA-N
MW186.21 g/mol
LogP1.20
Rot. Bonds

About 2,4,4a,9-tetrahydroindeno[2,1-c]pyridazin-3-one

2,4,4a,9-tetrahydroindeno[2,1-c]pyridazin-3-one (PubChem CID 3063371) has the molecular formula C11H10N2O and a molecular weight of 186.21 g/mol. Its IUPAC name is 2,4,4a,9-tetrahydroindeno[2,1-c]pyridazin-3-one.

Molecular Properties

Compound Name2,4,4a,9-tetrahydroindeno[2,1-c]pyridazin-3-one
PubChem CID3063371
Molecular FormulaC11H10N2O
Molecular Weight186.21 g/mol
Exact Mass186.08
IUPAC Name2,4,4a,9-tetrahydroindeno[2,1-c]pyridazin-3-one
SMILESO=C1CC2C(=NN1)Cc1ccccc12
InChIInChI=1S/C11H10N2O/c14-11-6-9-8-4-2-1-3-7(8)5-10(9)12-13-11/h1-4,9H,5-6H2,(H,13,14)
InChIKeyNSLWKAHYUAHLNR-UHFFFAOYSA-N
XLogP1.20
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-phenyl-4,5-dihydro-3(2H)-pyridazinone
CID 242935
4-benzyl-5-methyl-2,4-dihydro-3H-pyrazol-3-one
CID 2725675
3-Phenyl-5-pyrazolone
CID 78577
5-methyl-4-(2-methylbenzyl)-2,4-dihydro-3H-pyrazol-3-one
CID 5151511
3H-Indeno(1,2-c)pyridazin-3-one, 2,4,4a,5-tetrahydro-2-methyl-
CID 3052619
Benzo(h)cinnolin-3(2H)-one, 4,4a,5,6-tetrahydro-, (+-)-
CID 3078594
6-(4-isopropylstyryl)-4,5-dihydro-3(2H)-pyridazinone
CID 1471687
N'-(4-methylcyclohexylidene)-2-phenylacetohydrazide
CID 3616474
N'-(1-methyl-2-phenylethylidene)cyclohexanecarbohydrazide
CID 5454795
N-[(E)-1-(1,3-dioxoinden-2-yl)ethylideneamino]-3-phenylpropanamide
CID 9590713
N'-[(1E)-1-methyl-2-phenylethylidene]heptanohydrazide
CID 9667134
N'-(5-isopropenyl-2-methyl-2-cyclohexen-1-ylidene)-2-phenylcyclopropanecarbohydrazide
CID 6375710

Frequently Asked Questions

What is the IUPAC name of 2,4,4a,9-tetrahydroindeno[2,1-c]pyridazin-3-one?
The IUPAC name of 2,4,4a,9-tetrahydroindeno[2,1-c]pyridazin-3-one (CID 3063371) is 2,4,4a,9-tetrahydroindeno[2,1-c]pyridazin-3-one.
What is the SMILES notation for 2,4,4a,9-tetrahydroindeno[2,1-c]pyridazin-3-one?
The canonical SMILES for 2,4,4a,9-tetrahydroindeno[2,1-c]pyridazin-3-one is O=C1CC2C(=NN1)Cc1ccccc12.
What is the InChIKey of 2,4,4a,9-tetrahydroindeno[2,1-c]pyridazin-3-one?
The InChIKey is NSLWKAHYUAHLNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O/c14-11-6-9-8-4-2-1-3-7(8)5-10(9)12-13-11/h1-4,9H,5-6H2,(H,13,14).
What are the key properties of 2,4,4a,9-tetrahydroindeno[2,1-c]pyridazin-3-one?
2,4,4a,9-tetrahydroindeno[2,1-c]pyridazin-3-one has a molecular weight of 186.21 g/mol, XLogP of 1.20, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,4a,9-tetrahydroindeno[2,1-c]pyridazin-3-one is sourced from PubChem (CID 3063371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).