4-[2-(4-fluorophenyl)-3-(1H-indol-5-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine

C24H20FN5O — CID 122656030

IUPAC4-[2-(4-fluorophenyl)-3-(1H-indol-5-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine
SMILESFc1ccc(-c2nc3c(N4CCOCC4)nccn3c2-c2ccc3[nH]ccc3c2)cc1
InChIInChI=1S/C24H20FN5O/c25-19-4-1-16(2-5-19)21-22(18-3-6-20-17(15-18)7-8-26-20)30-10-9-27-23(24(30)28-21)29-11-13-31-14-12-29/h1-10,15,26H,11-14H2
InChIKeySRBPMUJFPYVOBZ-UHFFFAOYSA-N
MW413.46 g/mol
LogP4.52
Rot. Bonds3

About 4-[2-(4-fluorophenyl)-3-(1H-indol-5-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine

4-[2-(4-fluorophenyl)-3-(1H-indol-5-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine (PubChem CID 122656030) has the molecular formula C24H20FN5O and a molecular weight of 413.46 g/mol. Its IUPAC name is 4-[2-(4-fluorophenyl)-3-(1H-indol-5-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine.

Molecular Properties

Compound Name4-[2-(4-fluorophenyl)-3-(1H-indol-5-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine
PubChem CID122656030
Molecular FormulaC24H20FN5O
Molecular Weight413.46 g/mol
Exact Mass413.17
IUPAC Name4-[2-(4-fluorophenyl)-3-(1H-indol-5-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine
SMILESFc1ccc(-c2nc3c(N4CCOCC4)nccn3c2-c2ccc3[nH]ccc3c2)cc1
InChIInChI=1S/C24H20FN5O/c25-19-4-1-16(2-5-19)21-22(18-3-6-20-17(15-18)7-8-26-20)30-10-9-27-23(24(30)28-21)29-11-13-31-14-12-29/h1-10,15,26H,11-14H2
InChIKeySRBPMUJFPYVOBZ-UHFFFAOYSA-N
XLogP4.52
TPSA58.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms31
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.46
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-fluorophenyl)-3-(1H-indol-5-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine?
The IUPAC name of 4-[2-(4-fluorophenyl)-3-(1H-indol-5-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine (CID 122656030) is 4-[2-(4-fluorophenyl)-3-(1H-indol-5-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine.
What is the SMILES notation for 4-[2-(4-fluorophenyl)-3-(1H-indol-5-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine?
The canonical SMILES for 4-[2-(4-fluorophenyl)-3-(1H-indol-5-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine is Fc1ccc(-c2nc3c(N4CCOCC4)nccn3c2-c2ccc3[nH]ccc3c2)cc1.
What is the InChIKey of 4-[2-(4-fluorophenyl)-3-(1H-indol-5-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine?
The InChIKey is SRBPMUJFPYVOBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20FN5O/c25-19-4-1-16(2-5-19)21-22(18-3-6-20-17(15-18)7-8-26-20)30-10-9-27-23(24(30)28-21)29-11-13-31-14-12-29/h1-10,15,26H,11-14H2.
What are the key properties of 4-[2-(4-fluorophenyl)-3-(1H-indol-5-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine?
4-[2-(4-fluorophenyl)-3-(1H-indol-5-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine has a molecular weight of 413.46 g/mol, XLogP of 4.52, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-fluorophenyl)-3-(1H-indol-5-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine is sourced from PubChem (CID 122656030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).