2-tert-butyl-6-chloroimidazo[1,2-b]pyridazine

C10H12ClN3 — CID 10353044

IUPAC2-tert-butyl-6-chloroimidazo[1,2-b]pyridazine
SMILESCC(C)(C)c1cn2nc(Cl)ccc2n1
InChIInChI=1S/C10H12ClN3/c1-10(2,3)7-6-14-9(12-7)5-4-8(11)13-14/h4-6H,1-3H3
InChIKeyAIKJUIAALVIMPQ-UHFFFAOYSA-N
MW209.68 g/mol
LogP2.68
Rot. Bonds

About 2-tert-butyl-6-chloroimidazo[1,2-b]pyridazine

2-tert-butyl-6-chloroimidazo[1,2-b]pyridazine (PubChem CID 10353044) has the molecular formula C10H12ClN3 and a molecular weight of 209.68 g/mol. Its IUPAC name is 2-tert-butyl-6-chloroimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name2-tert-butyl-6-chloroimidazo[1,2-b]pyridazine
PubChem CID10353044
Molecular FormulaC10H12ClN3
Molecular Weight209.68 g/mol
Exact Mass209.07
IUPAC Name2-tert-butyl-6-chloroimidazo[1,2-b]pyridazine
SMILESCC(C)(C)c1cn2nc(Cl)ccc2n1
InChIInChI=1S/C10H12ClN3/c1-10(2,3)7-6-14-9(12-7)5-4-8(11)13-14/h4-6H,1-3H3
InChIKeyAIKJUIAALVIMPQ-UHFFFAOYSA-N
XLogP2.68
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.68
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-6-chloroimidazo[1,2-b]pyridazine?
The IUPAC name of 2-tert-butyl-6-chloroimidazo[1,2-b]pyridazine (CID 10353044) is 2-tert-butyl-6-chloroimidazo[1,2-b]pyridazine.
What is the SMILES notation for 2-tert-butyl-6-chloroimidazo[1,2-b]pyridazine?
The canonical SMILES for 2-tert-butyl-6-chloroimidazo[1,2-b]pyridazine is CC(C)(C)c1cn2nc(Cl)ccc2n1.
What is the InChIKey of 2-tert-butyl-6-chloroimidazo[1,2-b]pyridazine?
The InChIKey is AIKJUIAALVIMPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClN3/c1-10(2,3)7-6-14-9(12-7)5-4-8(11)13-14/h4-6H,1-3H3.
What are the key properties of 2-tert-butyl-6-chloroimidazo[1,2-b]pyridazine?
2-tert-butyl-6-chloroimidazo[1,2-b]pyridazine has a molecular weight of 209.68 g/mol, XLogP of 2.68, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-6-chloroimidazo[1,2-b]pyridazine is sourced from PubChem (CID 10353044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).