4-[5-piperidin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazin-8-yl]morpholine

C25H28N6O2 — CID 86345567

IUPAC4-[5-piperidin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazin-8-yl]morpholine
SMILESc1ccc2nc(OCc3cn4c(C5CCNCC5)cnc(N5CCOCC5)c4n3)ccc2c1
InChIInChI=1S/C25H28N6O2/c1-2-4-21-18(3-1)5-6-23(29-21)33-17-20-16-31-22(19-7-9-26-10-8-19)15-27-24(25(31)28-20)30-11-13-32-14-12-30/h1-6,15-16,19,26H,7-14,17H2
InChIKeyVKIDRHXOQAZJOG-UHFFFAOYSA-N
MW444.54 g/mol
LogP3.16
Rot. Bonds5

About 4-[5-piperidin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazin-8-yl]morpholine

4-[5-piperidin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazin-8-yl]morpholine (PubChem CID 86345567) has the molecular formula C25H28N6O2 and a molecular weight of 444.54 g/mol. Its IUPAC name is 4-[5-piperidin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazin-8-yl]morpholine.

Molecular Properties

Compound Name4-[5-piperidin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazin-8-yl]morpholine
PubChem CID86345567
Molecular FormulaC25H28N6O2
Molecular Weight444.54 g/mol
Exact Mass444.23
IUPAC Name4-[5-piperidin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazin-8-yl]morpholine
SMILESc1ccc2nc(OCc3cn4c(C5CCNCC5)cnc(N5CCOCC5)c4n3)ccc2c1
InChIInChI=1S/C25H28N6O2/c1-2-4-21-18(3-1)5-6-23(29-21)33-17-20-16-31-22(19-7-9-26-10-8-19)15-27-24(25(31)28-20)30-11-13-32-14-12-30/h1-6,15-16,19,26H,7-14,17H2
InChIKeyVKIDRHXOQAZJOG-UHFFFAOYSA-N
XLogP3.16
TPSA76.81 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500444.54
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 4-[5-piperidin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazin-8-yl]morpholine?
The IUPAC name of 4-[5-piperidin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazin-8-yl]morpholine (CID 86345567) is 4-[5-piperidin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazin-8-yl]morpholine.
What is the SMILES notation for 4-[5-piperidin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazin-8-yl]morpholine?
The canonical SMILES for 4-[5-piperidin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazin-8-yl]morpholine is c1ccc2nc(OCc3cn4c(C5CCNCC5)cnc(N5CCOCC5)c4n3)ccc2c1.
What is the InChIKey of 4-[5-piperidin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazin-8-yl]morpholine?
The InChIKey is VKIDRHXOQAZJOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N6O2/c1-2-4-21-18(3-1)5-6-23(29-21)33-17-20-16-31-22(19-7-9-26-10-8-19)15-27-24(25(31)28-20)30-11-13-32-14-12-30/h1-6,15-16,19,26H,7-14,17H2.
What are the key properties of 4-[5-piperidin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazin-8-yl]morpholine?
4-[5-piperidin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazin-8-yl]morpholine has a molecular weight of 444.54 g/mol, XLogP of 3.16, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-piperidin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazin-8-yl]morpholine is sourced from PubChem (CID 86345567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).