2-bromo-6-(2,5-dimethylphenyl)imidazo[1,2-b]pyridazine

C14H12BrN3 — CID 116854746

IUPAC2-bromo-6-(2,5-dimethylphenyl)imidazo[1,2-b]pyridazine
SMILESCc1ccc(C)c(-c2ccc3nc(Br)cn3n2)c1
InChIInChI=1S/C14H12BrN3/c1-9-3-4-10(2)11(7-9)12-5-6-14-16-13(15)8-18(14)17-12/h3-8H,1-2H3
InChIKeyZWUQPLLTFYLJJI-UHFFFAOYSA-N
MW302.18 g/mol
LogP3.78
Rot. Bonds1

About 2-bromo-6-(2,5-dimethylphenyl)imidazo[1,2-b]pyridazine

2-bromo-6-(2,5-dimethylphenyl)imidazo[1,2-b]pyridazine (PubChem CID 116854746) has the molecular formula C14H12BrN3 and a molecular weight of 302.18 g/mol. Its IUPAC name is 2-bromo-6-(2,5-dimethylphenyl)imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name2-bromo-6-(2,5-dimethylphenyl)imidazo[1,2-b]pyridazine
PubChem CID116854746
Molecular FormulaC14H12BrN3
Molecular Weight302.18 g/mol
Exact Mass301.02
IUPAC Name2-bromo-6-(2,5-dimethylphenyl)imidazo[1,2-b]pyridazine
SMILESCc1ccc(C)c(-c2ccc3nc(Br)cn3n2)c1
InChIInChI=1S/C14H12BrN3/c1-9-3-4-10(2)11(7-9)12-5-6-14-16-13(15)8-18(14)17-12/h3-8H,1-2H3
InChIKeyZWUQPLLTFYLJJI-UHFFFAOYSA-N
XLogP3.78
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.18
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-bromo-6-(2-methyl-5-propan-2-ylphenyl)imidazo[1,2-b]pyridazine
CID 116854791
3-bromo-6-(2,5-dimethylphenyl)imidazo[1,2-b]pyridazine
CID 116854656
2-bromo-4-(2,5-dimethylphenyl)-6-methylpyrimidine
CID 116897213
6-(2,5-dimethylphenyl)-2H-[1,2,4]triazolo[4,3-b]pyridazine-3-thione
CID 82105336
2-bromo-6-chloro-7-methylimidazo[1,2-b]pyridazine
CID 86618519
2-(2,5-dimethylphenyl)imidazo[1,2-a]pyridine
CID 4715291
2-bromo-6-methyl-[1,2,4]triazolo[1,5-a]pyridine
CID 71711015
2-bromo-6-(2,3-dihydro-1H-inden-5-yl)imidazo[1,2-b]pyridazine
CID 116854761
6-(3,4-dimethylphenyl)-2-methylimidazo[1,2-b]pyridazine
CID 116854838
2-[3-(2,5-dimethylphenyl)-6-oxopyridazin-1-yl]ethyl-diethylazanium
CID 7672172
2-(2,5-dimethylphenyl)quinoline
CID 1202732
2-[6-(2-bromophenyl)imidazo[1,2-b]pyridazin-2-yl]-N-methylethanamine
CID 116821637

Frequently Asked Questions

What is the IUPAC name of 2-bromo-6-(2,5-dimethylphenyl)imidazo[1,2-b]pyridazine?
The IUPAC name of 2-bromo-6-(2,5-dimethylphenyl)imidazo[1,2-b]pyridazine (CID 116854746) is 2-bromo-6-(2,5-dimethylphenyl)imidazo[1,2-b]pyridazine.
What is the SMILES notation for 2-bromo-6-(2,5-dimethylphenyl)imidazo[1,2-b]pyridazine?
The canonical SMILES for 2-bromo-6-(2,5-dimethylphenyl)imidazo[1,2-b]pyridazine is Cc1ccc(C)c(-c2ccc3nc(Br)cn3n2)c1.
What is the InChIKey of 2-bromo-6-(2,5-dimethylphenyl)imidazo[1,2-b]pyridazine?
The InChIKey is ZWUQPLLTFYLJJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrN3/c1-9-3-4-10(2)11(7-9)12-5-6-14-16-13(15)8-18(14)17-12/h3-8H,1-2H3.
What are the key properties of 2-bromo-6-(2,5-dimethylphenyl)imidazo[1,2-b]pyridazine?
2-bromo-6-(2,5-dimethylphenyl)imidazo[1,2-b]pyridazine has a molecular weight of 302.18 g/mol, XLogP of 3.78, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-6-(2,5-dimethylphenyl)imidazo[1,2-b]pyridazine is sourced from PubChem (CID 116854746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).