6-chloro-2-ethoxyimidazo[1,2-b]pyridazine

C8H8ClN3O — CID 14088205

IUPAC6-chloro-2-ethoxyimidazo[1,2-b]pyridazine
SMILESCCOc1cn2nc(Cl)ccc2n1
InChIInChI=1S/C8H8ClN3O/c1-2-13-8-5-12-7(10-8)4-3-6(9)11-12/h3-5H,2H2,1H3
InChIKeySBKGKTKQPOCZBI-UHFFFAOYSA-N
MW197.62 g/mol
LogP1.78
Rot. Bonds2

About 6-chloro-2-ethoxyimidazo[1,2-b]pyridazine

6-chloro-2-ethoxyimidazo[1,2-b]pyridazine (PubChem CID 14088205) has the molecular formula C8H8ClN3O and a molecular weight of 197.62 g/mol. Its IUPAC name is 6-chloro-2-ethoxyimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name6-chloro-2-ethoxyimidazo[1,2-b]pyridazine
PubChem CID14088205
Molecular FormulaC8H8ClN3O
Molecular Weight197.62 g/mol
Exact Mass197.04
IUPAC Name6-chloro-2-ethoxyimidazo[1,2-b]pyridazine
SMILESCCOc1cn2nc(Cl)ccc2n1
InChIInChI=1S/C8H8ClN3O/c1-2-13-8-5-12-7(10-8)4-3-6(9)11-12/h3-5H,2H2,1H3
InChIKeySBKGKTKQPOCZBI-UHFFFAOYSA-N
XLogP1.78
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.62
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-ethoxyimidazo[1,2-b]pyridazine?
The IUPAC name of 6-chloro-2-ethoxyimidazo[1,2-b]pyridazine (CID 14088205) is 6-chloro-2-ethoxyimidazo[1,2-b]pyridazine.
What is the SMILES notation for 6-chloro-2-ethoxyimidazo[1,2-b]pyridazine?
The canonical SMILES for 6-chloro-2-ethoxyimidazo[1,2-b]pyridazine is CCOc1cn2nc(Cl)ccc2n1.
What is the InChIKey of 6-chloro-2-ethoxyimidazo[1,2-b]pyridazine?
The InChIKey is SBKGKTKQPOCZBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClN3O/c1-2-13-8-5-12-7(10-8)4-3-6(9)11-12/h3-5H,2H2,1H3.
What are the key properties of 6-chloro-2-ethoxyimidazo[1,2-b]pyridazine?
6-chloro-2-ethoxyimidazo[1,2-b]pyridazine has a molecular weight of 197.62 g/mol, XLogP of 1.78, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-ethoxyimidazo[1,2-b]pyridazine is sourced from PubChem (CID 14088205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).