6-(2-methyl-4-pyridinyl)-3-[4-(oxetan-3-yl)piperazin-1-yl]imidazo[1,2-b]pyridazine

C19H22N6O — CID 146315976

IUPAC6-(2-methyl-4-pyridinyl)-3-[4-(oxetan-3-yl)piperazin-1-yl]imidazo[1,2-b]pyridazine
SMILESCc1cc(-c2ccc3ncc(N4CCN(C5COC5)CC4)n3n2)ccn1
InChIInChI=1S/C19H22N6O/c1-14-10-15(4-5-20-14)17-2-3-18-21-11-19(25(18)22-17)24-8-6-23(7-9-24)16-12-26-13-16/h2-5,10-11,16H,6-9,12-13H2,1H3
InChIKeyJTGBPQNLTBCZLU-UHFFFAOYSA-N
MW350.43 g/mol
LogP1.62
Rot. Bonds3

About 6-(2-methyl-4-pyridinyl)-3-[4-(oxetan-3-yl)piperazin-1-yl]imidazo[1,2-b]pyridazine

6-(2-methyl-4-pyridinyl)-3-[4-(oxetan-3-yl)piperazin-1-yl]imidazo[1,2-b]pyridazine (PubChem CID 146315976) has the molecular formula C19H22N6O and a molecular weight of 350.43 g/mol. Its IUPAC name is 6-(2-methyl-4-pyridinyl)-3-[4-(oxetan-3-yl)piperazin-1-yl]imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name6-(2-methyl-4-pyridinyl)-3-[4-(oxetan-3-yl)piperazin-1-yl]imidazo[1,2-b]pyridazine
PubChem CID146315976
Molecular FormulaC19H22N6O
Molecular Weight350.43 g/mol
Exact Mass350.19
IUPAC Name6-(2-methyl-4-pyridinyl)-3-[4-(oxetan-3-yl)piperazin-1-yl]imidazo[1,2-b]pyridazine
SMILESCc1cc(-c2ccc3ncc(N4CCN(C5COC5)CC4)n3n2)ccn1
InChIInChI=1S/C19H22N6O/c1-14-10-15(4-5-20-14)17-2-3-18-21-11-19(25(18)22-17)24-8-6-23(7-9-24)16-12-26-13-16/h2-5,10-11,16H,6-9,12-13H2,1H3
InChIKeyJTGBPQNLTBCZLU-UHFFFAOYSA-N
XLogP1.62
TPSA58.79 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.43
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-(2-methyl-4-pyridinyl)-3-[4-(oxetan-3-yl)piperazin-1-yl]imidazo[1,2-b]pyridazine?
The IUPAC name of 6-(2-methyl-4-pyridinyl)-3-[4-(oxetan-3-yl)piperazin-1-yl]imidazo[1,2-b]pyridazine (CID 146315976) is 6-(2-methyl-4-pyridinyl)-3-[4-(oxetan-3-yl)piperazin-1-yl]imidazo[1,2-b]pyridazine.
What is the SMILES notation for 6-(2-methyl-4-pyridinyl)-3-[4-(oxetan-3-yl)piperazin-1-yl]imidazo[1,2-b]pyridazine?
The canonical SMILES for 6-(2-methyl-4-pyridinyl)-3-[4-(oxetan-3-yl)piperazin-1-yl]imidazo[1,2-b]pyridazine is Cc1cc(-c2ccc3ncc(N4CCN(C5COC5)CC4)n3n2)ccn1.
What is the InChIKey of 6-(2-methyl-4-pyridinyl)-3-[4-(oxetan-3-yl)piperazin-1-yl]imidazo[1,2-b]pyridazine?
The InChIKey is JTGBPQNLTBCZLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O/c1-14-10-15(4-5-20-14)17-2-3-18-21-11-19(25(18)22-17)24-8-6-23(7-9-24)16-12-26-13-16/h2-5,10-11,16H,6-9,12-13H2,1H3.
What are the key properties of 6-(2-methyl-4-pyridinyl)-3-[4-(oxetan-3-yl)piperazin-1-yl]imidazo[1,2-b]pyridazine?
6-(2-methyl-4-pyridinyl)-3-[4-(oxetan-3-yl)piperazin-1-yl]imidazo[1,2-b]pyridazine has a molecular weight of 350.43 g/mol, XLogP of 1.62, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methyl-4-pyridinyl)-3-[4-(oxetan-3-yl)piperazin-1-yl]imidazo[1,2-b]pyridazine is sourced from PubChem (CID 146315976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).