2-(4-tert-butylphenyl)-6-chloroimidazo[1,2-b]pyridazine

C16H16ClN3 — CID 10379220

IUPAC2-(4-tert-butylphenyl)-6-chloroimidazo[1,2-b]pyridazine
SMILESCC(C)(C)c1ccc(-c2cn3nc(Cl)ccc3n2)cc1
InChIInChI=1S/C16H16ClN3/c1-16(2,3)12-6-4-11(5-7-12)13-10-20-15(18-13)9-8-14(17)19-20/h4-10H,1-3H3
InChIKeyULMMQGIERKODCN-UHFFFAOYSA-N
MW285.78 g/mol
LogP4.35
Rot. Bonds1

About 2-(4-tert-butylphenyl)-6-chloroimidazo[1,2-b]pyridazine

2-(4-tert-butylphenyl)-6-chloroimidazo[1,2-b]pyridazine (PubChem CID 10379220) has the molecular formula C16H16ClN3 and a molecular weight of 285.78 g/mol. Its IUPAC name is 2-(4-tert-butylphenyl)-6-chloroimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name2-(4-tert-butylphenyl)-6-chloroimidazo[1,2-b]pyridazine
PubChem CID10379220
Molecular FormulaC16H16ClN3
Molecular Weight285.78 g/mol
Exact Mass285.10
IUPAC Name2-(4-tert-butylphenyl)-6-chloroimidazo[1,2-b]pyridazine
SMILESCC(C)(C)c1ccc(-c2cn3nc(Cl)ccc3n2)cc1
InChIInChI=1S/C16H16ClN3/c1-16(2,3)12-6-4-11(5-7-12)13-10-20-15(18-13)9-8-14(17)19-20/h4-10H,1-3H3
InChIKeyULMMQGIERKODCN-UHFFFAOYSA-N
XLogP4.35
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.78
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-chloro-2-(4-chlorophenyl)imidazo[1,2-b]pyridazine
CID 15749998
6-chloro-2-(4-phenylphenyl)imidazo[1,2-b]pyridazine
CID 15032578
4-tert-butyl-N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)benzamide
CID 59175581
2-(1,3-benzodioxol-5-yl)-6-chloroimidazo[1,2-b]pyridazine
CID 15749997
N-[5-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-2-ethylphenyl]-2,2-dimethylpropanamide
CID 86667863
2-(6-chloroimidazo[1,2-b]pyridazin-2-yl)propan-2-ol
CID 58216650
2-(4-tert-butylphenyl)-6-iodoimidazo[1,2-a]pyridine
CID 10571546
3-(6-chloroimidazo[1,2-b]pyridazin-2-yl)benzonitrile
CID 46835564
4-tert-butyl-2-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-4,5-dihydro-1,3-oxazole
CID 175459027
2-(4-tert-butylphenyl)-6-methyl-[1,2,4]triazolo[1,5-a]pyridine
CID 82566407
N-[5-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-2-(trifluoromethoxy)phenyl]-2,2-dimethylpropanamide
CID 88541438
4-(4-tert-butylphenyl)-6-chloro-2-methylpyrimidine
CID 22135532

Frequently Asked Questions

What is the IUPAC name of 2-(4-tert-butylphenyl)-6-chloroimidazo[1,2-b]pyridazine?
The IUPAC name of 2-(4-tert-butylphenyl)-6-chloroimidazo[1,2-b]pyridazine (CID 10379220) is 2-(4-tert-butylphenyl)-6-chloroimidazo[1,2-b]pyridazine.
What is the SMILES notation for 2-(4-tert-butylphenyl)-6-chloroimidazo[1,2-b]pyridazine?
The canonical SMILES for 2-(4-tert-butylphenyl)-6-chloroimidazo[1,2-b]pyridazine is CC(C)(C)c1ccc(-c2cn3nc(Cl)ccc3n2)cc1.
What is the InChIKey of 2-(4-tert-butylphenyl)-6-chloroimidazo[1,2-b]pyridazine?
The InChIKey is ULMMQGIERKODCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClN3/c1-16(2,3)12-6-4-11(5-7-12)13-10-20-15(18-13)9-8-14(17)19-20/h4-10H,1-3H3.
What are the key properties of 2-(4-tert-butylphenyl)-6-chloroimidazo[1,2-b]pyridazine?
2-(4-tert-butylphenyl)-6-chloroimidazo[1,2-b]pyridazine has a molecular weight of 285.78 g/mol, XLogP of 4.35, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butylphenyl)-6-chloroimidazo[1,2-b]pyridazine is sourced from PubChem (CID 10379220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).