1-amino-5-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-indol-2-one

C24H21FN6O2 — CID 122663651

IUPAC1-amino-5-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-indol-2-one
SMILESNN1C(=O)Cc2cc(-c3c(-c4ccc(F)cc4)nc4c(N5CCOCC5)nccn34)ccc21
InChIInChI=1S/C24H21FN6O2/c25-18-4-1-15(2-5-18)21-22(16-3-6-19-17(13-16)14-20(32)31(19)26)30-8-7-27-23(24(30)28-21)29-9-11-33-12-10-29/h1-8,13H,9-12,14,26H2
InChIKeyNLFKEHFAAYHSSB-UHFFFAOYSA-N
MW444.47 g/mol
LogP2.80
Rot. Bonds3

About 1-amino-5-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-indol-2-one

1-amino-5-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-indol-2-one (PubChem CID 122663651) has the molecular formula C24H21FN6O2 and a molecular weight of 444.47 g/mol. Its IUPAC name is 1-amino-5-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-indol-2-one.

Molecular Properties

Compound Name1-amino-5-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-indol-2-one
PubChem CID122663651
Molecular FormulaC24H21FN6O2
Molecular Weight444.47 g/mol
Exact Mass444.17
IUPAC Name1-amino-5-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-indol-2-one
SMILESNN1C(=O)Cc2cc(-c3c(-c4ccc(F)cc4)nc4c(N5CCOCC5)nccn34)ccc21
InChIInChI=1S/C24H21FN6O2/c25-18-4-1-15(2-5-18)21-22(16-3-6-19-17(13-16)14-20(32)31(19)26)30-8-7-27-23(24(30)28-21)29-9-11-33-12-10-29/h1-8,13H,9-12,14,26H2
InChIKeyNLFKEHFAAYHSSB-UHFFFAOYSA-N
XLogP2.80
TPSA88.99 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500444.47
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Related Compounds

1-amino-5-[8-(1,1-dioxo-1,4-thiazinan-4-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-3H-indol-2-one
CID 122663669
3-fluoro-5-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]indol-1-amine
CID 122663692
4-[3-(2H-benzotriazol-5-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-8-yl]morpholine
CID 122655955
4-[2-(4-fluorophenyl)-3-(1H-indol-5-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine
CID 122656030
5-[8-(azetidin-1-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one
CID 122656128
5-[8-(1,1-dioxo-1,4-thiazinan-4-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one
CID 122656008
5-[2-(4-fluorophenyl)-8-[(3S)-3-methylmorpholin-4-yl]imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one
CID 122656091
6-[5-chloro-2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-4H-cinnolin-3-one
CID 122663682
4-[2-(4-fluorophenyl)-8-(2-oxa-6-azaspiro[3.3]heptan-6-yl)imidazo[1,2-a]pyrazin-3-yl]phenol
CID 137053623
8-morpholin-4-yl-2H-[1,2,4]triazolo[4,3-a]pyrazin-3-one
CID 50928582
[3-(2,2-dioxo-1,3-dihydro-2,1-benzothiazol-5-yl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl]-phenylmethanone
CID 122656216
4-[2-(4-chlorophenyl)-3-[1-(2-methoxyethyl)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-yl]morpholine
CID 155514050

Frequently Asked Questions

What is the IUPAC name of 1-amino-5-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-indol-2-one?
The IUPAC name of 1-amino-5-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-indol-2-one (CID 122663651) is 1-amino-5-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-indol-2-one.
What is the SMILES notation for 1-amino-5-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-indol-2-one?
The canonical SMILES for 1-amino-5-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-indol-2-one is NN1C(=O)Cc2cc(-c3c(-c4ccc(F)cc4)nc4c(N5CCOCC5)nccn34)ccc21.
What is the InChIKey of 1-amino-5-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-indol-2-one?
The InChIKey is NLFKEHFAAYHSSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21FN6O2/c25-18-4-1-15(2-5-18)21-22(16-3-6-19-17(13-16)14-20(32)31(19)26)30-8-7-27-23(24(30)28-21)29-9-11-33-12-10-29/h1-8,13H,9-12,14,26H2.
What are the key properties of 1-amino-5-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-indol-2-one?
1-amino-5-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-indol-2-one has a molecular weight of 444.47 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-5-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-indol-2-one is sourced from PubChem (CID 122663651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).