1-[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(3,4-dichlorophenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(4-methylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(4-methylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one

C176H228Cl4N24O8 — CID 173099539

About 1-[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(3,4-dichlorophenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(4-methylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(4-methylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one

1-[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(3,4-dichlorophenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(4-methylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(4-methylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one (PubChem CID 173099539) has the molecular formula C176H228Cl4N24O8 and a molecular weight of 2949.73 g/mol. Its IUPAC name is 1-[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(3,4-dichlorophenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(4-methylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(4-methylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one.

Molecular Properties

• Compound Name: 1-[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(3,4-dichlorophenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(4-methylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(4-methylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one
• PubChem CID: 173099539
• Molecular Formula: C176H228Cl4N24O8
• Molecular Weight: 2949.73 g/mol
• Exact Mass: 2945.69
• IUPAC Name: 1-[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(3,4-dichlorophenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(4-methylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(4-methylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one
• SMILES: Cc1ccc(N2CCN(CCCCn3ccc4c3CCCC4=O)CC2)cc1.Cc1ccc(N2CCN(CCCn3ccc4c3CCCC4=O)CC2)cc1.Cc1ccc(N2CCN(CCn3ccc4c3CCCC4=O)CC2)cc1.Cc1cccc(N2CCN(CCCCn3ccc4c3CCCC4=O)CC2)c1C.Cc1cccc(N2CCN(CCCn3ccc4c3CCCC4=O)CC2)c1C.Cc1cccc(N2CCN(CCn3ccc4c3CCCC4=O)CC2)c1C.O=C1CCCc2c1ccn2CCCN1CCN(c2ccc(Cl)c(Cl)c2)CC1.O=C1CCCc2c1ccn2CCN1CCN(c2ccc(Cl)c(Cl)c2)CC1
• InChI: InChI=1S/C24H33N3O.2C23H31N3O.2C22H29N3O.C21H25Cl2N3O.C21H27N3O.C20H23Cl2N3O/c1-19-7-5-8-22(20(19)2)27-17-15-25(16-18-27)12-3-4-13-26-14-11-21-23(26)9-6-10-24(21)28;1-18-6-3-7-21(19(18)2)26-16-14-24(15-17-26)11-5-12-25-13-10-20-22(25)8-4-9-23(20)27;1-19-7-9-20(10-8-19)25-17-15-24(16-18-25)12-2-3-13-26-14-11-21-22(26)5-4-6-23(21)27;1-17-5-3-6-20(18(17)2)25-15-12-23(13-16-25)11-14-24-10-9-19-21(24)7-4-8-22(19)26;1-18-6-8-19(9-7-18)24-16-14-23(15-17-24)11-3-12-25-13-10-20-21(25)4-2-5-22(20)26;22-18-6-5-16(15-19(18)23)25-13-11-24(12-14-25)8-2-9-26-10-7-17-20(26)3-1-4-21(17)27;1-17-5-7-18(8-6-17)23-14-11-22(12-15-23)13-16-24-10-9-19-20(24)3-2-4-21(19)25;21-17-5-4-15(14-18(17)22)24-11-8-23(9-12-24)10-13-25-7-6-16-19(25)2-1-3-20(16)26/h5,7-8,11,14H,3-4,6,9-10,12-13,15-18H2,1-2H3;3,6-7,10,13H,4-5,8-9,11-12,14-17H2,1-2H3;7-11,14H,2-6,12-13,15-18H2,1H3;3,5-6,9-10H,4,7-8,11-16H2,1-2H3;6-10,13H,2-5,11-12,14-17H2,1H3;5-7,10,15H,1-4,8-9,11-14H2;5-10H,2-4,11-16H2,1H3;4-7,14H,1-3,8-13H2
• InChIKey: ZZXPMSGBUSYQPE-UHFFFAOYSA-N
• XLogP: 30.75
• TPSA: 227.84 Ų
• H-Bond Acceptors: 32
• Rotatable Bonds: 39
• Heavy Atoms: 212
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2949.73
LogP ≤ 5	30.75
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(3,4-dichlorophenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(4-methylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(4-methylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one?

The IUPAC name of 1-[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(3,4-dichlorophenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(4-methylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(4-methylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one (CID 173099539) is 1-[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(3,4-dichlorophenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(4-methylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(4-methylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one.

What is the SMILES notation for 1-[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(3,4-dichlorophenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(4-methylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(4-methylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one?

The canonical SMILES for 1-[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(3,4-dichlorophenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(4-methylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(4-methylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one is Cc1ccc(N2CCN(CCCCn3ccc4c3CCCC4=O)CC2)cc1.Cc1ccc(N2CCN(CCCn3ccc4c3CCCC4=O)CC2)cc1.Cc1ccc(N2CCN(CCn3ccc4c3CCCC4=O)CC2)cc1.Cc1cccc(N2CCN(CCCCn3ccc4c3CCCC4=O)CC2)c1C.Cc1cccc(N2CCN(CCCn3ccc4c3CCCC4=O)CC2)c1C.Cc1cccc(N2CCN(CCn3ccc4c3CCCC4=O)CC2)c1C.O=C1CCCc2c1ccn2CCCN1CCN(c2ccc(Cl)c(Cl)c2)CC1.O=C1CCCc2c1ccn2CCN1CCN(c2ccc(Cl)c(Cl)c2)CC1.

What is the InChIKey of 1-[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(3,4-dichlorophenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(4-methylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(4-methylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one?

The InChIKey is ZZXPMSGBUSYQPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N3O.2C23H31N3O.2C22H29N3O.C21H25Cl2N3O.C21H27N3O.C20H23Cl2N3O/c1-19-7-5-8-22(20(19)2)27-17-15-25(16-18-27)12-3-4-13-26-14-11-21-23(26)9-6-10-24(21)28;1-18-6-3-7-21(19(18)2)26-16-14-24(15-17-26)11-5-12-25-13-10-20-22(25)8-4-9-23(20)27;1-19-7-9-20(10-8-19)25-17-15-24(16-18-25)12-2-3-13-26-14-11-21-22(26)5-4-6-23(21)27;1-17-5-3-6-20(18(17)2)25-15-12-23(13-16-25)11-14-24-10-9-19-21(24)7-4-8-22(19)26;1-18-6-8-19(9-7-18)24-16-14-23(15-17-24)11-3-12-25-13-10-20-21(25)4-2-5-22(20)26;22-18-6-5-16(15-19(18)23)25-13-11-24(12-14-25)8-2-9-26-10-7-17-20(26)3-1-4-21(17)27;1-17-5-7-18(8-6-17)23-14-11-22(12-15-23)13-16-24-10-9-19-20(24)3-2-4-21(19)25;21-17-5-4-15(14-18(17)22)24-11-8-23(9-12-24)10-13-25-7-6-16-19(25)2-1-3-20(16)26/h5,7-8,11,14H,3-4,6,9-10,12-13,15-18H2,1-2H3;3,6-7,10,13H,4-5,8-9,11-12,14-17H2,1-2H3;7-11,14H,2-6,12-13,15-18H2,1H3;3,5-6,9-10H,4,7-8,11-16H2,1-2H3;6-10,13H,2-5,11-12,14-17H2,1H3;5-7,10,15H,1-4,8-9,11-14H2;5-10H,2-4,11-16H2,1H3;4-7,14H,1-3,8-13H2.

What are the key properties of 1-[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(3,4-dichlorophenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(4-methylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(4-methylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one?

1-[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(3,4-dichlorophenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(4-methylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(4-methylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one has a molecular weight of 2949.73 g/mol, XLogP of 30.75, 39 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(3,4-dichlorophenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one;1-[4-[4-(4-methylphenyl)piperazin-1-yl]butyl]-6,7-dihydro-5H-indol-4-one;1-[2-[4-(4-methylphenyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-indol-4-one;1-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-6,7-dihydro-5H-indol-4-one is sourced from PubChem (CID 173099539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).