3-tert-butyl-6-chloro-2-methylimidazo[1,2-b]pyridazine

C11H14ClN3 — CID 154620858

IUPAC3-tert-butyl-6-chloro-2-methylimidazo[1,2-b]pyridazine
SMILESCc1nc2ccc(Cl)nn2c1C(C)(C)C
InChIInChI=1S/C11H14ClN3/c1-7-10(11(2,3)4)15-9(13-7)6-5-8(12)14-15/h5-6H,1-4H3
InChIKeyDCDNLPRXKCIXIR-UHFFFAOYSA-N
MW223.71 g/mol
LogP2.99
Rot. Bonds

About 3-tert-butyl-6-chloro-2-methylimidazo[1,2-b]pyridazine

3-tert-butyl-6-chloro-2-methylimidazo[1,2-b]pyridazine (PubChem CID 154620858) has the molecular formula C11H14ClN3 and a molecular weight of 223.71 g/mol. Its IUPAC name is 3-tert-butyl-6-chloro-2-methylimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name3-tert-butyl-6-chloro-2-methylimidazo[1,2-b]pyridazine
PubChem CID154620858
Molecular FormulaC11H14ClN3
Molecular Weight223.71 g/mol
Exact Mass223.09
IUPAC Name3-tert-butyl-6-chloro-2-methylimidazo[1,2-b]pyridazine
SMILESCc1nc2ccc(Cl)nn2c1C(C)(C)C
InChIInChI=1S/C11H14ClN3/c1-7-10(11(2,3)4)15-9(13-7)6-5-8(12)14-15/h5-6H,1-4H3
InChIKeyDCDNLPRXKCIXIR-UHFFFAOYSA-N
XLogP2.99
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.71
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-chloro-3-methylimidazo[1,2-b]pyridazine-2-carbonitrile
CID 90135335
3-tert-butyl-2,6-dimethylimidazo[1,2-a]pyridine
CID 143656817
2-(4-tert-butylphenyl)-6-chloroimidazo[1,2-b]pyridazine
CID 10379220
2-(6-chloroimidazo[1,2-b]pyridazin-2-yl)propan-2-ol
CID 58216650
6-chloro-3-(2,5-dimethylpyrazol-3-yl)-[1,2,4]triazolo[4,3-b]pyridazine
CID 66128201
6-chloro-3-(6-methyl-3-pyridinyl)-[1,2,4]triazolo[4,3-b]pyridazine
CID 43144377
6-chloro-3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazine
CID 39732405
2-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-N,N,2-trimethylpropanamide
CID 10978418
8-bromo-6-chloro-2,3-dimethylimidazo[1,2-b]pyridazine
CID 86611746
4-tert-butyl-N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)benzamide
CID 59175581
tert-butyl-(6-chloroimidazo[1,2-b]pyridazin-2-yl)carbamic acid
CID 174214091
N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-2,2-dimethylpropanamide
CID 90246038

Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-6-chloro-2-methylimidazo[1,2-b]pyridazine?
The IUPAC name of 3-tert-butyl-6-chloro-2-methylimidazo[1,2-b]pyridazine (CID 154620858) is 3-tert-butyl-6-chloro-2-methylimidazo[1,2-b]pyridazine.
What is the SMILES notation for 3-tert-butyl-6-chloro-2-methylimidazo[1,2-b]pyridazine?
The canonical SMILES for 3-tert-butyl-6-chloro-2-methylimidazo[1,2-b]pyridazine is Cc1nc2ccc(Cl)nn2c1C(C)(C)C.
What is the InChIKey of 3-tert-butyl-6-chloro-2-methylimidazo[1,2-b]pyridazine?
The InChIKey is DCDNLPRXKCIXIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN3/c1-7-10(11(2,3)4)15-9(13-7)6-5-8(12)14-15/h5-6H,1-4H3.
What are the key properties of 3-tert-butyl-6-chloro-2-methylimidazo[1,2-b]pyridazine?
3-tert-butyl-6-chloro-2-methylimidazo[1,2-b]pyridazine has a molecular weight of 223.71 g/mol, XLogP of 2.99, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tert-butyl-6-chloro-2-methylimidazo[1,2-b]pyridazine is sourced from PubChem (CID 154620858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).