3-ethyl-2-methyl-6-(4-methylpiperazin-1-yl)imidazo[1,2-b]pyridazine

C14H21N5 — CID 91493052

IUPAC3-ethyl-2-methyl-6-(4-methylpiperazin-1-yl)imidazo[1,2-b]pyridazine
SMILESCCc1c(C)nc2ccc(N3CCN(C)CC3)nn12
InChIInChI=1S/C14H21N5/c1-4-12-11(2)15-13-5-6-14(16-19(12)13)18-9-7-17(3)8-10-18/h5-6H,4,7-10H2,1-3H3
InChIKeyZHMIMMIDEYHWQE-UHFFFAOYSA-N
MW259.36 g/mol
LogP1.35
Rot. Bonds2

About 3-ethyl-2-methyl-6-(4-methylpiperazin-1-yl)imidazo[1,2-b]pyridazine

3-ethyl-2-methyl-6-(4-methylpiperazin-1-yl)imidazo[1,2-b]pyridazine (PubChem CID 91493052) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is 3-ethyl-2-methyl-6-(4-methylpiperazin-1-yl)imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name3-ethyl-2-methyl-6-(4-methylpiperazin-1-yl)imidazo[1,2-b]pyridazine
PubChem CID91493052
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC Name3-ethyl-2-methyl-6-(4-methylpiperazin-1-yl)imidazo[1,2-b]pyridazine
SMILESCCc1c(C)nc2ccc(N3CCN(C)CC3)nn12
InChIInChI=1S/C14H21N5/c1-4-12-11(2)15-13-5-6-14(16-19(12)13)18-9-7-17(3)8-10-18/h5-6H,4,7-10H2,1-3H3
InChIKeyZHMIMMIDEYHWQE-UHFFFAOYSA-N
XLogP1.35
TPSA36.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-methyl-6-(4-methylpiperazin-1-yl)imidazo[1,2-b]pyridazine?
The IUPAC name of 3-ethyl-2-methyl-6-(4-methylpiperazin-1-yl)imidazo[1,2-b]pyridazine (CID 91493052) is 3-ethyl-2-methyl-6-(4-methylpiperazin-1-yl)imidazo[1,2-b]pyridazine.
What is the SMILES notation for 3-ethyl-2-methyl-6-(4-methylpiperazin-1-yl)imidazo[1,2-b]pyridazine?
The canonical SMILES for 3-ethyl-2-methyl-6-(4-methylpiperazin-1-yl)imidazo[1,2-b]pyridazine is CCc1c(C)nc2ccc(N3CCN(C)CC3)nn12.
What is the InChIKey of 3-ethyl-2-methyl-6-(4-methylpiperazin-1-yl)imidazo[1,2-b]pyridazine?
The InChIKey is ZHMIMMIDEYHWQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-4-12-11(2)15-13-5-6-14(16-19(12)13)18-9-7-17(3)8-10-18/h5-6H,4,7-10H2,1-3H3.
What are the key properties of 3-ethyl-2-methyl-6-(4-methylpiperazin-1-yl)imidazo[1,2-b]pyridazine?
3-ethyl-2-methyl-6-(4-methylpiperazin-1-yl)imidazo[1,2-b]pyridazine has a molecular weight of 259.36 g/mol, XLogP of 1.35, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-methyl-6-(4-methylpiperazin-1-yl)imidazo[1,2-b]pyridazine is sourced from PubChem (CID 91493052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).