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6-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-2-methylimidazo[1,2-b]pyridazine

C17H21N7 — CID 155974777

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPAC6-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-2-methylimidazo[1,2-b]pyridazine
SMILESCc1cc(C)nc(N2CCN(c3ccc4nc(C)cn4n3)CC2)n1
InChIInChI=1S/C17H21N7/c1-12-10-13(2)20-17(19-12)23-8-6-22(7-9-23)16-5-4-15-18-14(3)11-24(15)21-16/h4-5,10-11H,6-9H2,1-3H3
InChIKeyJFSRJWQTLMBZFD-UHFFFAOYSA-N
MW323.40 g/mol
LogP1.77
Rot. Bonds2

About 6-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-2-methylimidazo[1,2-b]pyridazine

6-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-2-methylimidazo[1,2-b]pyridazine (PubChem CID 155974777) has the molecular formula C17H21N7 and a molecular weight of 323.40 g/mol. Its IUPAC name is 6-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-2-methylimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name6-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-2-methylimidazo[1,2-b]pyridazine
PubChem CID155974777
Molecular FormulaC17H21N7
Molecular Weight323.40 g/mol
Exact Mass323.19
IUPAC Name6-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-2-methylimidazo[1,2-b]pyridazine
SMILESCc1cc(C)nc(N2CCN(c3ccc4nc(C)cn4n3)CC2)n1
InChIInChI=1S/C17H21N7/c1-12-10-13(2)20-17(19-12)23-8-6-22(7-9-23)16-5-4-15-18-14(3)11-24(15)21-16/h4-5,10-11H,6-9H2,1-3H3
InChIKeyJFSRJWQTLMBZFD-UHFFFAOYSA-N
XLogP1.77
TPSA62.45 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-2-methylimidazo[1,2-b]pyridazine?
The IUPAC name of 6-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-2-methylimidazo[1,2-b]pyridazine (CID 155974777) is 6-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-2-methylimidazo[1,2-b]pyridazine.
What is the SMILES notation for 6-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-2-methylimidazo[1,2-b]pyridazine?
The canonical SMILES for 6-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-2-methylimidazo[1,2-b]pyridazine is Cc1cc(C)nc(N2CCN(c3ccc4nc(C)cn4n3)CC2)n1.
What is the InChIKey of 6-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-2-methylimidazo[1,2-b]pyridazine?
The InChIKey is JFSRJWQTLMBZFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N7/c1-12-10-13(2)20-17(19-12)23-8-6-22(7-9-23)16-5-4-15-18-14(3)11-24(15)21-16/h4-5,10-11H,6-9H2,1-3H3.
What are the key properties of 6-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-2-methylimidazo[1,2-b]pyridazine?
6-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-2-methylimidazo[1,2-b]pyridazine has a molecular weight of 323.40 g/mol, XLogP of 1.77, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-2-methylimidazo[1,2-b]pyridazine is sourced from PubChem (CID 155974777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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