4-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-[2-(4-fluorophenyl)ethyl]piperazin-2-one;4-[2-(4-fluorophenyl)ethyl]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(5-methyl-2-prop-1-en-2-yl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)piperazin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-pyridin-2-ylethyl)piperazin-2-one;4-(2-phenylethyl)-1-(2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-7-yl)piperazin-2-one

C147H170ClF2N25O6 — CID 157309352

About 4-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-[2-(4-fluorophenyl)ethyl]piperazin-2-one;4-[2-(4-fluorophenyl)ethyl]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(5-methyl-2-prop-1-en-2-yl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)piperazin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-pyridin-2-ylethyl)piperazin-2-one;4-(2-phenylethyl)-1-(2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-7-yl)piperazin-2-one

4-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-[2-(4-fluorophenyl)ethyl]piperazin-2-one;4-[2-(4-fluorophenyl)ethyl]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(5-methyl-2-prop-1-en-2-yl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)piperazin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-pyridin-2-ylethyl)piperazin-2-one;4-(2-phenylethyl)-1-(2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-7-yl)piperazin-2-one (PubChem CID 157309352) has the molecular formula C147H170ClF2N25O6 and a molecular weight of 2456.59 g/mol. Its IUPAC name is 4-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-[2-(4-fluorophenyl)ethyl]piperazin-2-one;4-[2-(4-fluorophenyl)ethyl]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(5-methyl-2-prop-1-en-2-yl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)piperazin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-pyridin-2-ylethyl)piperazin-2-one;4-(2-phenylethyl)-1-(2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-7-yl)piperazin-2-one.

Molecular Properties

• Compound Name: 4-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-[2-(4-fluorophenyl)ethyl]piperazin-2-one;4-[2-(4-fluorophenyl)ethyl]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(5-methyl-2-prop-1-en-2-yl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)piperazin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-pyridin-2-ylethyl)piperazin-2-one;4-(2-phenylethyl)-1-(2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-7-yl)piperazin-2-one
• PubChem CID: 157309352
• Molecular Formula: C147H170ClF2N25O6
• Molecular Weight: 2456.59 g/mol
• Exact Mass: 2454.34
• IUPAC Name: 4-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-[2-(4-fluorophenyl)ethyl]piperazin-2-one;4-[2-(4-fluorophenyl)ethyl]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(5-methyl-2-prop-1-en-2-yl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)piperazin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-pyridin-2-ylethyl)piperazin-2-one;4-(2-phenylethyl)-1-(2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-7-yl)piperazin-2-one
• SMILES: C=C(C)N1CCc2c(c3ccc(N4CCN(CCc5ccccc5)CC4=O)cc3n2C)C1.CC1Cc2c(c3ccc(N4CCN(CCc5ccc(Cl)cc5)CC4=O)cc3n2C)CN1.CC1Cc2c(c3ccc(N4CCN(CCc5ccc(F)cc5)CC4=O)cc3n2C)CN1.Cn1c2c(c3ccc(N4CCN(CCc5ccc(F)cc5)CC4=O)cc31)CNCC2.Cn1c2c(c3ccc(N4CCN(CCc5ccccn5)CC4=O)cc31)CNCC2.O=C1CN(CCc2ccccc2)CCN1c1ccc2c3c([nH]c2c1)CCNC3
• InChI: InChI=1S/C27H32N4O.C25H29ClN4O.C25H29FN4O.C24H27FN4O.C23H27N5O.C23H26N4O/c1-20(2)30-14-12-25-24(18-30)23-10-9-22(17-26(23)28(25)3)31-16-15-29(19-27(31)32)13-11-21-7-5-4-6-8-21;2*1-17-13-23-22(15-27-17)21-8-7-20(14-24(21)28(23)2)30-12-11-29(16-25(30)31)10-9-18-3-5-19(26)6-4-18;1-27-22-8-10-26-15-21(22)20-7-6-19(14-23(20)27)29-13-12-28(16-24(29)30)11-9-17-2-4-18(25)5-3-17;1-26-21-7-10-24-15-20(21)19-6-5-18(14-22(19)26)28-13-12-27(16-23(28)29)11-8-17-4-2-3-9-25-17;28-23-16-26(11-9-17-4-2-1-3-5-17)12-13-27(23)18-6-7-19-20-15-24-10-8-21(20)25-22(19)14-18/h4-10,17H,1,11-16,18-19H2,2-3H3;2*3-8,14,17,27H,9-13,15-16H2,1-2H3;2-7,14,26H,8-13,15-16H2,1H3;2-6,9,14,24H,7-8,10-13,15-16H2,1H3;1-7,14,24-25H,8-13,15-16H2
• InChIKey: BCVWMAOZSMHYCL-UHFFFAOYSA-N
• XLogP: 18.63
• TPSA: 258.02 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 24
• Rotatable Bonds: 25
• Heavy Atoms: 181
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2456.59
LogP ≤ 5	18.63
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-[2-(4-fluorophenyl)ethyl]piperazin-2-one;4-[2-(4-fluorophenyl)ethyl]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(5-methyl-2-prop-1-en-2-yl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)piperazin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-pyridin-2-ylethyl)piperazin-2-one;4-(2-phenylethyl)-1-(2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-7-yl)piperazin-2-one?

The IUPAC name of 4-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-[2-(4-fluorophenyl)ethyl]piperazin-2-one;4-[2-(4-fluorophenyl)ethyl]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(5-methyl-2-prop-1-en-2-yl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)piperazin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-pyridin-2-ylethyl)piperazin-2-one;4-(2-phenylethyl)-1-(2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-7-yl)piperazin-2-one (CID 157309352) is 4-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-[2-(4-fluorophenyl)ethyl]piperazin-2-one;4-[2-(4-fluorophenyl)ethyl]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(5-methyl-2-prop-1-en-2-yl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)piperazin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-pyridin-2-ylethyl)piperazin-2-one;4-(2-phenylethyl)-1-(2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-7-yl)piperazin-2-one.

What is the SMILES notation for 4-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-[2-(4-fluorophenyl)ethyl]piperazin-2-one;4-[2-(4-fluorophenyl)ethyl]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(5-methyl-2-prop-1-en-2-yl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)piperazin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-pyridin-2-ylethyl)piperazin-2-one;4-(2-phenylethyl)-1-(2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-7-yl)piperazin-2-one?

The canonical SMILES for 4-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-[2-(4-fluorophenyl)ethyl]piperazin-2-one;4-[2-(4-fluorophenyl)ethyl]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(5-methyl-2-prop-1-en-2-yl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)piperazin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-pyridin-2-ylethyl)piperazin-2-one;4-(2-phenylethyl)-1-(2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-7-yl)piperazin-2-one is C=C(C)N1CCc2c(c3ccc(N4CCN(CCc5ccccc5)CC4=O)cc3n2C)C1.CC1Cc2c(c3ccc(N4CCN(CCc5ccc(Cl)cc5)CC4=O)cc3n2C)CN1.CC1Cc2c(c3ccc(N4CCN(CCc5ccc(F)cc5)CC4=O)cc3n2C)CN1.Cn1c2c(c3ccc(N4CCN(CCc5ccc(F)cc5)CC4=O)cc31)CNCC2.Cn1c2c(c3ccc(N4CCN(CCc5ccccn5)CC4=O)cc31)CNCC2.O=C1CN(CCc2ccccc2)CCN1c1ccc2c3c([nH]c2c1)CCNC3.

What is the InChIKey of 4-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-[2-(4-fluorophenyl)ethyl]piperazin-2-one;4-[2-(4-fluorophenyl)ethyl]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(5-methyl-2-prop-1-en-2-yl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)piperazin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-pyridin-2-ylethyl)piperazin-2-one;4-(2-phenylethyl)-1-(2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-7-yl)piperazin-2-one?

The InChIKey is BCVWMAOZSMHYCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H32N4O.C25H29ClN4O.C25H29FN4O.C24H27FN4O.C23H27N5O.C23H26N4O/c1-20(2)30-14-12-25-24(18-30)23-10-9-22(17-26(23)28(25)3)31-16-15-29(19-27(31)32)13-11-21-7-5-4-6-8-21;2*1-17-13-23-22(15-27-17)21-8-7-20(14-24(21)28(23)2)30-12-11-29(16-25(30)31)10-9-18-3-5-19(26)6-4-18;1-27-22-8-10-26-15-21(22)20-7-6-19(14-23(20)27)29-13-12-28(16-24(29)30)11-9-17-2-4-18(25)5-3-17;1-26-21-7-10-24-15-20(21)19-6-5-18(14-22(19)26)28-13-12-27(16-23(28)29)11-8-17-4-2-3-9-25-17;28-23-16-26(11-9-17-4-2-1-3-5-17)12-13-27(23)18-6-7-19-20-15-24-10-8-21(20)25-22(19)14-18/h4-10,17H,1,11-16,18-19H2,2-3H3;2*3-8,14,17,27H,9-13,15-16H2,1-2H3;2-7,14,26H,8-13,15-16H2,1H3;2-6,9,14,24H,7-8,10-13,15-16H2,1H3;1-7,14,24-25H,8-13,15-16H2.

What are the key properties of 4-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-[2-(4-fluorophenyl)ethyl]piperazin-2-one;4-[2-(4-fluorophenyl)ethyl]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(5-methyl-2-prop-1-en-2-yl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)piperazin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-pyridin-2-ylethyl)piperazin-2-one;4-(2-phenylethyl)-1-(2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-7-yl)piperazin-2-one?

4-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-[2-(4-fluorophenyl)ethyl]piperazin-2-one;4-[2-(4-fluorophenyl)ethyl]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(5-methyl-2-prop-1-en-2-yl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)piperazin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-pyridin-2-ylethyl)piperazin-2-one;4-(2-phenylethyl)-1-(2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-7-yl)piperazin-2-one has a molecular weight of 2456.59 g/mol, XLogP of 18.63, 25 rotatable bonds, 6 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(3,5-dimethyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-[2-(4-fluorophenyl)ethyl]piperazin-2-one;4-[2-(4-fluorophenyl)ethyl]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)piperazin-2-one;1-(5-methyl-2-prop-1-en-2-yl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)piperazin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-pyridin-2-ylethyl)piperazin-2-one;4-(2-phenylethyl)-1-(2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-7-yl)piperazin-2-one is sourced from PubChem (CID 157309352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).