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

C20H21N7O — CID 71138986

IUPAC4-[2-methyl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine
SMILESCc1nc2c(N3CCOCC3)nccn2c1-c1cnn(Cc2ccncc2)c1
InChIInChI=1S/C20H21N7O/c1-15-18(17-12-23-26(14-17)13-16-2-4-21-5-3-16)27-7-6-22-19(20(27)24-15)25-8-10-28-11-9-25/h2-7,12,14H,8-11,13H2,1H3
InChIKeyMYGDMTAGMBHPNC-UHFFFAOYSA-N
MW375.44 g/mol
LogP2.18
Rot. Bonds4

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

4-[2-methyl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine (PubChem CID 71138986) has the molecular formula C20H21N7O and a molecular weight of 375.44 g/mol. Its IUPAC name is 4-[2-methyl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine.

Molecular Properties

Compound Name4-[2-methyl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine
PubChem CID71138986
Molecular FormulaC20H21N7O
Molecular Weight375.44 g/mol
Exact Mass375.18
IUPAC Name4-[2-methyl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine
SMILESCc1nc2c(N3CCOCC3)nccn2c1-c1cnn(Cc2ccncc2)c1
InChIInChI=1S/C20H21N7O/c1-15-18(17-12-23-26(14-17)13-16-2-4-21-5-3-16)27-7-6-22-19(20(27)24-15)25-8-10-28-11-9-25/h2-7,12,14H,8-11,13H2,1H3
InChIKeyMYGDMTAGMBHPNC-UHFFFAOYSA-N
XLogP2.18
TPSA73.37 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.44
LogP ≤ 52.18
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-(pyridin-4-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine?
The IUPAC name of 4-[2-methyl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine (CID 71138986) is 4-[2-methyl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine.
What is the SMILES notation for 4-[2-methyl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine?
The canonical SMILES for 4-[2-methyl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine is Cc1nc2c(N3CCOCC3)nccn2c1-c1cnn(Cc2ccncc2)c1.
What is the InChIKey of 4-[2-methyl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine?
The InChIKey is MYGDMTAGMBHPNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N7O/c1-15-18(17-12-23-26(14-17)13-16-2-4-21-5-3-16)27-7-6-22-19(20(27)24-15)25-8-10-28-11-9-25/h2-7,12,14H,8-11,13H2,1H3.
What are the key properties of 4-[2-methyl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine?
4-[2-methyl-3-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine has a molecular weight of 375.44 g/mol, XLogP of 2.18, 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-(pyridin-4-ylmethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine is sourced from PubChem (CID 71138986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).