3-bromo-6-(2,3-dihydro-1H-inden-5-yl)-2-methylimidazo[1,2-b]pyridazine

C16H14BrN3 — CID 116854950

IUPAC3-bromo-6-(2,3-dihydro-1H-inden-5-yl)-2-methylimidazo[1,2-b]pyridazine
SMILESCc1nc2ccc(-c3ccc4c(c3)CCC4)nn2c1Br
InChIInChI=1S/C16H14BrN3/c1-10-16(17)20-15(18-10)8-7-14(19-20)13-6-5-11-3-2-4-12(11)9-13/h5-9H,2-4H2,1H3
InChIKeyZYWFUGRESWDGIH-UHFFFAOYSA-N
MW328.21 g/mol
LogP3.96
Rot. Bonds1

About 3-bromo-6-(2,3-dihydro-1H-inden-5-yl)-2-methylimidazo[1,2-b]pyridazine

3-bromo-6-(2,3-dihydro-1H-inden-5-yl)-2-methylimidazo[1,2-b]pyridazine (PubChem CID 116854950) has the molecular formula C16H14BrN3 and a molecular weight of 328.21 g/mol. Its IUPAC name is 3-bromo-6-(2,3-dihydro-1H-inden-5-yl)-2-methylimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name3-bromo-6-(2,3-dihydro-1H-inden-5-yl)-2-methylimidazo[1,2-b]pyridazine
PubChem CID116854950
Molecular FormulaC16H14BrN3
Molecular Weight328.21 g/mol
Exact Mass327.04
IUPAC Name3-bromo-6-(2,3-dihydro-1H-inden-5-yl)-2-methylimidazo[1,2-b]pyridazine
SMILESCc1nc2ccc(-c3ccc4c(c3)CCC4)nn2c1Br
InChIInChI=1S/C16H14BrN3/c1-10-16(17)20-15(18-10)8-7-14(19-20)13-6-5-11-3-2-4-12(11)9-13/h5-9H,2-4H2,1H3
InChIKeyZYWFUGRESWDGIH-UHFFFAOYSA-N
XLogP3.96
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.21
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-bromo-6-(2,3-dihydro-1H-inden-5-yl)-2-methylimidazo[1,2-b]pyridazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-bromo-6-(2,3-dihydro-1H-inden-5-yl)imidazo[1,2-b]pyridazine
CID 116854761
2-[6-(5,6,7,8-tetrahydronaphthalen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]acetic acid
CID 82167208
5-(4-methylphenyl)-2,3-dihydro-1H-indene
CID 59217485
1-[2-(2,3-dihydro-1H-inden-5-yl)-4-methyl-1,3-thiazol-5-yl]ethanamine
CID 116884493
(2S)-2-[7-(4-chlorophenyl)-5-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrimidin-6-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid
CID 66692198
3-bromo-6-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazine
CID 116854655
4-(2,3-dihydro-1H-inden-5-yl)imidazole-1,2-diamine
CID 82284524
5-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazo[1,2-a]pyridine;hydroiodide
CID 19214757
3-[4-(2,3-dihydro-1H-inden-5-yl)-6-methylpyrimidin-2-yl]propan-1-amine
CID 116892881
3,5-dimethyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazo[1,2-a]pyridin-6-amine
CID 82060083
4-amino-2-methyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridazin-3-one
CID 82467444
2-methyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyrimidine-4-carbonitrile
CID 116857857

Frequently Asked Questions

What is the IUPAC name of 3-bromo-6-(2,3-dihydro-1H-inden-5-yl)-2-methylimidazo[1,2-b]pyridazine?
The IUPAC name of 3-bromo-6-(2,3-dihydro-1H-inden-5-yl)-2-methylimidazo[1,2-b]pyridazine (CID 116854950) is 3-bromo-6-(2,3-dihydro-1H-inden-5-yl)-2-methylimidazo[1,2-b]pyridazine.
What is the SMILES notation for 3-bromo-6-(2,3-dihydro-1H-inden-5-yl)-2-methylimidazo[1,2-b]pyridazine?
The canonical SMILES for 3-bromo-6-(2,3-dihydro-1H-inden-5-yl)-2-methylimidazo[1,2-b]pyridazine is Cc1nc2ccc(-c3ccc4c(c3)CCC4)nn2c1Br.
What is the InChIKey of 3-bromo-6-(2,3-dihydro-1H-inden-5-yl)-2-methylimidazo[1,2-b]pyridazine?
The InChIKey is ZYWFUGRESWDGIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14BrN3/c1-10-16(17)20-15(18-10)8-7-14(19-20)13-6-5-11-3-2-4-12(11)9-13/h5-9H,2-4H2,1H3.
What are the key properties of 3-bromo-6-(2,3-dihydro-1H-inden-5-yl)-2-methylimidazo[1,2-b]pyridazine?
3-bromo-6-(2,3-dihydro-1H-inden-5-yl)-2-methylimidazo[1,2-b]pyridazine has a molecular weight of 328.21 g/mol, XLogP of 3.96, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-6-(2,3-dihydro-1H-inden-5-yl)-2-methylimidazo[1,2-b]pyridazine is sourced from PubChem (CID 116854950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).