6-hexan-3-yl-2-methylimidazo[1,2-b]pyridazine

C13H19N3 — CID 139355107

IUPAC6-hexan-3-yl-2-methylimidazo[1,2-b]pyridazine
SMILESCCCC(CC)c1ccc2nc(C)cn2n1
InChIInChI=1S/C13H19N3/c1-4-6-11(5-2)12-7-8-13-14-10(3)9-16(13)15-12/h7-9,11H,4-6H2,1-3H3
InChIKeyZEWUXDUAZBXNOA-UHFFFAOYSA-N
MW217.32 g/mol
LogP3.33
Rot. Bonds4

About 6-hexan-3-yl-2-methylimidazo[1,2-b]pyridazine

6-hexan-3-yl-2-methylimidazo[1,2-b]pyridazine (PubChem CID 139355107) has the molecular formula C13H19N3 and a molecular weight of 217.32 g/mol. Its IUPAC name is 6-hexan-3-yl-2-methylimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name6-hexan-3-yl-2-methylimidazo[1,2-b]pyridazine
PubChem CID139355107
Molecular FormulaC13H19N3
Molecular Weight217.32 g/mol
Exact Mass217.16
IUPAC Name6-hexan-3-yl-2-methylimidazo[1,2-b]pyridazine
SMILESCCCC(CC)c1ccc2nc(C)cn2n1
InChIInChI=1S/C13H19N3/c1-4-6-11(5-2)12-7-8-13-14-10(3)9-16(13)15-12/h7-9,11H,4-6H2,1-3H3
InChIKeyZEWUXDUAZBXNOA-UHFFFAOYSA-N
XLogP3.33
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.32
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-hexan-3-yl-2-methylimidazo[1,2-b]pyridazine?
The IUPAC name of 6-hexan-3-yl-2-methylimidazo[1,2-b]pyridazine (CID 139355107) is 6-hexan-3-yl-2-methylimidazo[1,2-b]pyridazine.
What is the SMILES notation for 6-hexan-3-yl-2-methylimidazo[1,2-b]pyridazine?
The canonical SMILES for 6-hexan-3-yl-2-methylimidazo[1,2-b]pyridazine is CCCC(CC)c1ccc2nc(C)cn2n1.
What is the InChIKey of 6-hexan-3-yl-2-methylimidazo[1,2-b]pyridazine?
The InChIKey is ZEWUXDUAZBXNOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3/c1-4-6-11(5-2)12-7-8-13-14-10(3)9-16(13)15-12/h7-9,11H,4-6H2,1-3H3.
What are the key properties of 6-hexan-3-yl-2-methylimidazo[1,2-b]pyridazine?
6-hexan-3-yl-2-methylimidazo[1,2-b]pyridazine has a molecular weight of 217.32 g/mol, XLogP of 3.33, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hexan-3-yl-2-methylimidazo[1,2-b]pyridazine is sourced from PubChem (CID 139355107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).