5-(2-benzoyl-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl)-1,3-dihydroindol-2-one

C25H21N5O3 — CID 122656069

IUPAC5-(2-benzoyl-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl)-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(-c3c(C(=O)c4ccccc4)nc4c(N5CCOCC5)nccn34)ccc2N1
InChIInChI=1S/C25H21N5O3/c31-20-15-18-14-17(6-7-19(18)27-20)22-21(23(32)16-4-2-1-3-5-16)28-25-24(26-8-9-30(22)25)29-10-12-33-13-11-29/h1-9,14H,10-13,15H2,(H,27,31)
InChIKeyZKKOBIRDZDDYCP-UHFFFAOYSA-N
MW439.48 g/mol
LogP2.96
Rot. Bonds4

About 5-(2-benzoyl-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl)-1,3-dihydroindol-2-one

5-(2-benzoyl-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl)-1,3-dihydroindol-2-one (PubChem CID 122656069) has the molecular formula C25H21N5O3 and a molecular weight of 439.48 g/mol. Its IUPAC name is 5-(2-benzoyl-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name5-(2-benzoyl-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl)-1,3-dihydroindol-2-one
PubChem CID122656069
Molecular FormulaC25H21N5O3
Molecular Weight439.48 g/mol
Exact Mass439.16
IUPAC Name5-(2-benzoyl-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl)-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(-c3c(C(=O)c4ccccc4)nc4c(N5CCOCC5)nccn34)ccc2N1
InChIInChI=1S/C25H21N5O3/c31-20-15-18-14-17(6-7-19(18)27-20)22-21(23(32)16-4-2-1-3-5-16)28-25-24(26-8-9-30(22)25)29-10-12-33-13-11-29/h1-9,14H,10-13,15H2,(H,27,31)
InChIKeyZKKOBIRDZDDYCP-UHFFFAOYSA-N
XLogP2.96
TPSA88.83 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500439.48
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-(2-benzoyl-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl)-1,3-dihydroindol-2-one?
The IUPAC name of 5-(2-benzoyl-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl)-1,3-dihydroindol-2-one (CID 122656069) is 5-(2-benzoyl-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl)-1,3-dihydroindol-2-one.
What is the SMILES notation for 5-(2-benzoyl-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl)-1,3-dihydroindol-2-one?
The canonical SMILES for 5-(2-benzoyl-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl)-1,3-dihydroindol-2-one is O=C1Cc2cc(-c3c(C(=O)c4ccccc4)nc4c(N5CCOCC5)nccn34)ccc2N1.
What is the InChIKey of 5-(2-benzoyl-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl)-1,3-dihydroindol-2-one?
The InChIKey is ZKKOBIRDZDDYCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21N5O3/c31-20-15-18-14-17(6-7-19(18)27-20)22-21(23(32)16-4-2-1-3-5-16)28-25-24(26-8-9-30(22)25)29-10-12-33-13-11-29/h1-9,14H,10-13,15H2,(H,27,31).
What are the key properties of 5-(2-benzoyl-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl)-1,3-dihydroindol-2-one?
5-(2-benzoyl-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl)-1,3-dihydroindol-2-one has a molecular weight of 439.48 g/mol, XLogP of 2.96, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-benzoyl-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl)-1,3-dihydroindol-2-one is sourced from PubChem (CID 122656069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).