4-[5-(2,6-dimethyl-8-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)-2-pyridinyl]morpholine

C22H22N6O — CID 67461598

IUPAC4-[5-(2,6-dimethyl-8-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)-2-pyridinyl]morpholine
SMILESCc1cc(-c2ccncc2)c2nc(C)c(-c3ccc(N4CCOCC4)nc3)n2n1
InChIInChI=1S/C22H22N6O/c1-15-13-19(17-5-7-23-8-6-17)22-25-16(2)21(28(22)26-15)18-3-4-20(24-14-18)27-9-11-29-12-10-27/h3-8,13-14H,9-12H2,1-2H3
InChIKeyPGKFOZXSJXWQQL-UHFFFAOYSA-N
MW386.46 g/mol
LogP3.31
Rot. Bonds3

About 4-[5-(2,6-dimethyl-8-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)-2-pyridinyl]morpholine

4-[5-(2,6-dimethyl-8-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)-2-pyridinyl]morpholine (PubChem CID 67461598) has the molecular formula C22H22N6O and a molecular weight of 386.46 g/mol. Its IUPAC name is 4-[5-(2,6-dimethyl-8-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)-2-pyridinyl]morpholine.

Molecular Properties

Compound Name4-[5-(2,6-dimethyl-8-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)-2-pyridinyl]morpholine
PubChem CID67461598
Molecular FormulaC22H22N6O
Molecular Weight386.46 g/mol
Exact Mass386.19
IUPAC Name4-[5-(2,6-dimethyl-8-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)-2-pyridinyl]morpholine
SMILESCc1cc(-c2ccncc2)c2nc(C)c(-c3ccc(N4CCOCC4)nc3)n2n1
InChIInChI=1S/C22H22N6O/c1-15-13-19(17-5-7-23-8-6-17)22-25-16(2)21(28(22)26-15)18-3-4-20(24-14-18)27-9-11-29-12-10-27/h3-8,13-14H,9-12H2,1-2H3
InChIKeyPGKFOZXSJXWQQL-UHFFFAOYSA-N
XLogP3.31
TPSA68.44 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.46
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-[5-(2,6-dimethyl-8-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)-2-pyridinyl]morpholine?
The IUPAC name of 4-[5-(2,6-dimethyl-8-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)-2-pyridinyl]morpholine (CID 67461598) is 4-[5-(2,6-dimethyl-8-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)-2-pyridinyl]morpholine.
What is the SMILES notation for 4-[5-(2,6-dimethyl-8-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)-2-pyridinyl]morpholine?
The canonical SMILES for 4-[5-(2,6-dimethyl-8-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)-2-pyridinyl]morpholine is Cc1cc(-c2ccncc2)c2nc(C)c(-c3ccc(N4CCOCC4)nc3)n2n1.
What is the InChIKey of 4-[5-(2,6-dimethyl-8-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)-2-pyridinyl]morpholine?
The InChIKey is PGKFOZXSJXWQQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N6O/c1-15-13-19(17-5-7-23-8-6-17)22-25-16(2)21(28(22)26-15)18-3-4-20(24-14-18)27-9-11-29-12-10-27/h3-8,13-14H,9-12H2,1-2H3.
What are the key properties of 4-[5-(2,6-dimethyl-8-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)-2-pyridinyl]morpholine?
4-[5-(2,6-dimethyl-8-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)-2-pyridinyl]morpholine has a molecular weight of 386.46 g/mol, XLogP of 3.31, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(2,6-dimethyl-8-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)-2-pyridinyl]morpholine is sourced from PubChem (CID 67461598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).