5-[8-(4-acetylpiperazin-1-yl)-2-benzyl-5-methylimidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;5-[8-(4-acetylpiperazin-1-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;6-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-1,3-benzoxazol-2-one

C77H69F2N17O7 — CID 122656021

IUPAC5-[8-(4-acetylpiperazin-1-yl)-2-benzyl-5-methylimidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;5-[8-(4-acetylpiperazin-1-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;6-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-1,3-benzoxazol-2-one
SMILESCC(=O)N1CCN(c2ncc(C)n3c(-c4ccc5c(c4)CC(=O)N5)c(Cc4ccccc4)nc23)CC1.CC(=O)N1CCN(c2nccn3c(-c4ccc5c(c4)CC(=O)N5)c(-c4ccc(F)cc4)nc23)CC1.O=c1[nH]c2ccc(-c3c(-c4ccc(F)cc4)nc4c(N5CCOCC5)nccn34)cc2o1
InChIInChI=1S/C28H28N6O2.C26H23FN6O2.C23H18FN5O3/c1-18-17-29-27(33-12-10-32(11-13-33)19(2)35)28-31-24(14-20-6-4-3-5-7-20)26(34(18)28)21-8-9-23-22(15-21)16-25(36)30-23;1-16(34)31-10-12-32(13-11-31)25-26-30-23(17-2-5-20(27)6-3-17)24(33(26)9-8-28-25)18-4-7-21-19(14-18)15-22(35)29-21;24-16-4-1-14(2-5-16)19-20(15-3-6-17-18(13-15)32-23(30)26-17)29-8-7-25-21(22(29)27-19)28-9-11-31-12-10-28/h3-9,15,17H,10-14,16H2,1-2H3,(H,30,36);2-9,14H,10-13,15H2,1H3,(H,29,35);1-8,13H,9-12H2,(H,26,30)
InChIKeyCBTFTCAKBDIWRS-UHFFFAOYSA-N
MW1382.51 g/mol
LogP10.30
Rot. Bonds10

About 5-[8-(4-acetylpiperazin-1-yl)-2-benzyl-5-methylimidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;5-[8-(4-acetylpiperazin-1-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;6-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-1,3-benzoxazol-2-one

5-[8-(4-acetylpiperazin-1-yl)-2-benzyl-5-methylimidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;5-[8-(4-acetylpiperazin-1-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;6-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-1,3-benzoxazol-2-one (PubChem CID 122656021) has the molecular formula C77H69F2N17O7 and a molecular weight of 1382.51 g/mol. Its IUPAC name is 5-[8-(4-acetylpiperazin-1-yl)-2-benzyl-5-methylimidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;5-[8-(4-acetylpiperazin-1-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;6-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-1,3-benzoxazol-2-one.

Molecular Properties

Compound Name5-[8-(4-acetylpiperazin-1-yl)-2-benzyl-5-methylimidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;5-[8-(4-acetylpiperazin-1-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;6-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-1,3-benzoxazol-2-one
PubChem CID122656021
Molecular FormulaC77H69F2N17O7
Molecular Weight1382.51 g/mol
Exact Mass1381.55
IUPAC Name5-[8-(4-acetylpiperazin-1-yl)-2-benzyl-5-methylimidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;5-[8-(4-acetylpiperazin-1-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;6-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-1,3-benzoxazol-2-one
SMILESCC(=O)N1CCN(c2ncc(C)n3c(-c4ccc5c(c4)CC(=O)N5)c(Cc4ccccc4)nc23)CC1.CC(=O)N1CCN(c2nccn3c(-c4ccc5c(c4)CC(=O)N5)c(-c4ccc(F)cc4)nc23)CC1.O=c1[nH]c2ccc(-c3c(-c4ccc(F)cc4)nc4c(N5CCOCC5)nccn34)cc2o1
InChIInChI=1S/C28H28N6O2.C26H23FN6O2.C23H18FN5O3/c1-18-17-29-27(33-12-10-32(11-13-33)19(2)35)28-31-24(14-20-6-4-3-5-7-20)26(34(18)28)21-8-9-23-22(15-21)16-25(36)30-23;1-16(34)31-10-12-32(13-11-31)25-26-30-23(17-2-5-20(27)6-3-17)24(33(26)9-8-28-25)18-4-7-21-19(14-18)15-22(35)29-21;24-16-4-1-14(2-5-16)19-20(15-3-6-17-18(13-15)32-23(30)26-17)29-8-7-25-21(22(29)27-19)28-9-11-31-12-10-28/h3-9,15,17H,10-14,16H2,1-2H3,(H,30,36);2-9,14H,10-13,15H2,1H3,(H,29,35);1-8,13H,9-12H2,(H,26,30)
InChIKeyCBTFTCAKBDIWRS-UHFFFAOYSA-N
XLogP10.30
TPSA254.34 Ų
H-Bond Donors3
H-Bond Acceptors19
Rotatable Bonds10
Heavy Atoms103
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001382.51
LogP ≤ 510.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1019

Analyze 5-[8-(4-acetylpiperazin-1-yl)-2-benzyl-5-methylimidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;5-[8-(4-acetylpiperazin-1-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;6-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-1,3-benzoxazol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[8-(4-acetylpiperazin-1-yl)-2-benzyl-5-methylimidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;5-[8-(4-acetylpiperazin-1-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;6-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-1,3-benzoxazol-2-one?
The IUPAC name of 5-[8-(4-acetylpiperazin-1-yl)-2-benzyl-5-methylimidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;5-[8-(4-acetylpiperazin-1-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;6-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-1,3-benzoxazol-2-one (CID 122656021) is 5-[8-(4-acetylpiperazin-1-yl)-2-benzyl-5-methylimidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;5-[8-(4-acetylpiperazin-1-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;6-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-1,3-benzoxazol-2-one.
What is the SMILES notation for 5-[8-(4-acetylpiperazin-1-yl)-2-benzyl-5-methylimidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;5-[8-(4-acetylpiperazin-1-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;6-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-1,3-benzoxazol-2-one?
The canonical SMILES for 5-[8-(4-acetylpiperazin-1-yl)-2-benzyl-5-methylimidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;5-[8-(4-acetylpiperazin-1-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;6-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-1,3-benzoxazol-2-one is CC(=O)N1CCN(c2ncc(C)n3c(-c4ccc5c(c4)CC(=O)N5)c(Cc4ccccc4)nc23)CC1.CC(=O)N1CCN(c2nccn3c(-c4ccc5c(c4)CC(=O)N5)c(-c4ccc(F)cc4)nc23)CC1.O=c1[nH]c2ccc(-c3c(-c4ccc(F)cc4)nc4c(N5CCOCC5)nccn34)cc2o1.
What is the InChIKey of 5-[8-(4-acetylpiperazin-1-yl)-2-benzyl-5-methylimidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;5-[8-(4-acetylpiperazin-1-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;6-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-1,3-benzoxazol-2-one?
The InChIKey is CBTFTCAKBDIWRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H28N6O2.C26H23FN6O2.C23H18FN5O3/c1-18-17-29-27(33-12-10-32(11-13-33)19(2)35)28-31-24(14-20-6-4-3-5-7-20)26(34(18)28)21-8-9-23-22(15-21)16-25(36)30-23;1-16(34)31-10-12-32(13-11-31)25-26-30-23(17-2-5-20(27)6-3-17)24(33(26)9-8-28-25)18-4-7-21-19(14-18)15-22(35)29-21;24-16-4-1-14(2-5-16)19-20(15-3-6-17-18(13-15)32-23(30)26-17)29-8-7-25-21(22(29)27-19)28-9-11-31-12-10-28/h3-9,15,17H,10-14,16H2,1-2H3,(H,30,36);2-9,14H,10-13,15H2,1H3,(H,29,35);1-8,13H,9-12H2,(H,26,30).
What are the key properties of 5-[8-(4-acetylpiperazin-1-yl)-2-benzyl-5-methylimidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;5-[8-(4-acetylpiperazin-1-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;6-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-1,3-benzoxazol-2-one?
5-[8-(4-acetylpiperazin-1-yl)-2-benzyl-5-methylimidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;5-[8-(4-acetylpiperazin-1-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;6-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-1,3-benzoxazol-2-one has a molecular weight of 1382.51 g/mol, XLogP of 10.30, 10 rotatable bonds, 3 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[8-(4-acetylpiperazin-1-yl)-2-benzyl-5-methylimidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;5-[8-(4-acetylpiperazin-1-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one;6-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-1,3-benzoxazol-2-one is sourced from PubChem (CID 122656021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).