4-[2-methyl-3-[1-(quinolin-2-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine

C24H23N7O — CID 71139236

IUPAC4-[2-methyl-3-[1-(quinolin-2-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine
SMILESCc1nc2c(N3CCOCC3)nccn2c1-c1cnn(Cc2ccc3ccccc3n2)c1
InChIInChI=1S/C24H23N7O/c1-17-22(31-9-8-25-23(24(31)27-17)29-10-12-32-13-11-29)19-14-26-30(15-19)16-20-7-6-18-4-2-3-5-21(18)28-20/h2-9,14-15H,10-13,16H2,1H3
InChIKeyXAIHQMIYPOPALA-UHFFFAOYSA-N
MW425.50 g/mol
LogP3.33
Rot. Bonds4

About 4-[2-methyl-3-[1-(quinolin-2-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine

4-[2-methyl-3-[1-(quinolin-2-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine (PubChem CID 71139236) has the molecular formula C24H23N7O and a molecular weight of 425.50 g/mol. Its IUPAC name is 4-[2-methyl-3-[1-(quinolin-2-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine.

Molecular Properties

Compound Name4-[2-methyl-3-[1-(quinolin-2-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine
PubChem CID71139236
Molecular FormulaC24H23N7O
Molecular Weight425.50 g/mol
Exact Mass425.20
IUPAC Name4-[2-methyl-3-[1-(quinolin-2-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine
SMILESCc1nc2c(N3CCOCC3)nccn2c1-c1cnn(Cc2ccc3ccccc3n2)c1
InChIInChI=1S/C24H23N7O/c1-17-22(31-9-8-25-23(24(31)27-17)29-10-12-32-13-11-29)19-14-26-30(15-19)16-20-7-6-18-4-2-3-5-21(18)28-20/h2-9,14-15H,10-13,16H2,1H3
InChIKeyXAIHQMIYPOPALA-UHFFFAOYSA-N
XLogP3.33
TPSA73.37 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.50
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 4-[2-methyl-3-[1-(quinolin-2-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine?
The IUPAC name of 4-[2-methyl-3-[1-(quinolin-2-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine (CID 71139236) is 4-[2-methyl-3-[1-(quinolin-2-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine.
What is the SMILES notation for 4-[2-methyl-3-[1-(quinolin-2-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine?
The canonical SMILES for 4-[2-methyl-3-[1-(quinolin-2-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine is Cc1nc2c(N3CCOCC3)nccn2c1-c1cnn(Cc2ccc3ccccc3n2)c1.
What is the InChIKey of 4-[2-methyl-3-[1-(quinolin-2-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine?
The InChIKey is XAIHQMIYPOPALA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N7O/c1-17-22(31-9-8-25-23(24(31)27-17)29-10-12-32-13-11-29)19-14-26-30(15-19)16-20-7-6-18-4-2-3-5-21(18)28-20/h2-9,14-15H,10-13,16H2,1H3.
What are the key properties of 4-[2-methyl-3-[1-(quinolin-2-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine?
4-[2-methyl-3-[1-(quinolin-2-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine has a molecular weight of 425.50 g/mol, XLogP of 3.33, 4 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-methyl-3-[1-(quinolin-2-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine is sourced from PubChem (CID 71139236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).