5-[8-(diethylamino)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one

C24H22FN5O — CID 122655899

IUPAC5-[8-(diethylamino)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one
SMILESCCN(CC)c1nccn2c(-c3ccc4c(c3)CC(=O)N4)c(-c3ccc(F)cc3)nc12
InChIInChI=1S/C24H22FN5O/c1-3-29(4-2)23-24-28-21(15-5-8-18(25)9-6-15)22(30(24)12-11-26-23)16-7-10-19-17(13-16)14-20(31)27-19/h5-13H,3-4,14H2,1-2H3,(H,27,31)
InChIKeyMRFCFJAQCIYLHF-UHFFFAOYSA-N
MW415.47 g/mol
LogP4.54
Rot. Bonds5

About 5-[8-(diethylamino)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one

5-[8-(diethylamino)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one (PubChem CID 122655899) has the molecular formula C24H22FN5O and a molecular weight of 415.47 g/mol. Its IUPAC name is 5-[8-(diethylamino)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name5-[8-(diethylamino)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one
PubChem CID122655899
Molecular FormulaC24H22FN5O
Molecular Weight415.47 g/mol
Exact Mass415.18
IUPAC Name5-[8-(diethylamino)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one
SMILESCCN(CC)c1nccn2c(-c3ccc4c(c3)CC(=O)N4)c(-c3ccc(F)cc3)nc12
InChIInChI=1S/C24H22FN5O/c1-3-29(4-2)23-24-28-21(15-5-8-18(25)9-6-15)22(30(24)12-11-26-23)16-7-10-19-17(13-16)14-20(31)27-19/h5-13H,3-4,14H2,1-2H3,(H,27,31)
InChIKeyMRFCFJAQCIYLHF-UHFFFAOYSA-N
XLogP4.54
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.47
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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
5-[8-(5-azaspiro[2.3]hexan-5-yl)-2-phenylimidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one
CID 122656210
5-(2-phenylimidazo[1,2-a]pyrazin-3-yl)-1,3-dihydroindol-2-one
CID 122656101
1-amino-5-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-indol-2-one
CID 122663651
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
5-[8-amino-6-(4-fluorophenyl)imidazo[1,2-a]pyrazin-5-yl]-3-methyl-1H-pyridin-2-one
CID 137372612
5-(2-amino-5-ethyl-1,3-oxazol-4-yl)-1,3-dihydroindol-2-one
CID 116831905
4-[3-(2H-benzotriazol-5-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-8-yl]morpholine
CID 122655955
5-(3-aminoimidazo[1,2-a]pyridin-2-yl)-1,3-dihydroindol-2-one
CID 82355772
4-[8-(1-ethyl-3,6-dihydro-2H-pyridin-4-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]phenol
CID 146855424

Frequently Asked Questions

What is the IUPAC name of 5-[8-(diethylamino)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one?
The IUPAC name of 5-[8-(diethylamino)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one (CID 122655899) is 5-[8-(diethylamino)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one.
What is the SMILES notation for 5-[8-(diethylamino)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one?
The canonical SMILES for 5-[8-(diethylamino)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one is CCN(CC)c1nccn2c(-c3ccc4c(c3)CC(=O)N4)c(-c3ccc(F)cc3)nc12.
What is the InChIKey of 5-[8-(diethylamino)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one?
The InChIKey is MRFCFJAQCIYLHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22FN5O/c1-3-29(4-2)23-24-28-21(15-5-8-18(25)9-6-15)22(30(24)12-11-26-23)16-7-10-19-17(13-16)14-20(31)27-19/h5-13H,3-4,14H2,1-2H3,(H,27,31).
What are the key properties of 5-[8-(diethylamino)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one?
5-[8-(diethylamino)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one has a molecular weight of 415.47 g/mol, XLogP of 4.54, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[8-(diethylamino)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one is sourced from PubChem (CID 122655899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).