1-(2,2-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;1-(2,5-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;N-ethyl-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;1-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-pyrrolidin-1-ylethane-1,2-dione

C149H172F5N15O15 — CID 161400196

About 1-(2,2-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;1-(2,5-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;N-ethyl-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;1-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-pyrrolidin-1-ylethane-1,2-dione

1-(2,2-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;1-(2,5-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;N-ethyl-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;1-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-pyrrolidin-1-ylethane-1,2-dione (PubChem CID 161400196) has the molecular formula C149H172F5N15O15 and a molecular weight of 2508.09 g/mol. Its IUPAC name is 1-(2,2-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;1-(2,5-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;N-ethyl-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;1-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-pyrrolidin-1-ylethane-1,2-dione.

Molecular Properties

• Compound Name: 1-(2,2-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;1-(2,5-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;N-ethyl-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;1-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-pyrrolidin-1-ylethane-1,2-dione
• PubChem CID: 161400196
• Molecular Formula: C149H172F5N15O15
• Molecular Weight: 2508.09 g/mol
• Exact Mass: 2506.31
• IUPAC Name: 1-(2,2-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;1-(2,5-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;N-ethyl-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;1-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-pyrrolidin-1-ylethane-1,2-dione
• SMILES: CCN(C(=O)C(=O)c1cn(C)c2cc(C)c(C(=O)N3CCC(Cc4ccc(F)cc4)CC3)cc12)C(C)C.Cc1cc2c(cc1C(=O)N1CCC(Cc3ccc(F)cc3)CC1)c(C(=O)C(=O)N1C(C)CCC1C)cn2C.Cc1cc2c(cc1C(=O)N1CCC(Cc3ccc(F)cc3)CC1)c(C(=O)C(=O)N1CCCC1(C)C)cn2C.Cc1cc2c(cc1C(=O)N1CCC(Cc3ccc(F)cc3)CC1)c(C(=O)C(=O)N1CCCC1)cn2C.Cc1cc2c(cc1C(=O)N1CCC(Cc3ccc(F)cc3)CC1)c(C(=O)C(=O)NC(C)C)cn2C
• InChI: InChI=1S/2C31H36FN3O3.C30H36FN3O3.C29H32FN3O3.C28H32FN3O3/c1-20-16-27-25(26(19-33(27)4)28(36)30(38)35-13-5-12-31(35,2)3)18-24(20)29(37)34-14-10-22(11-15-34)17-21-6-8-23(32)9-7-21;1-19-15-28-26(27(18-33(28)4)29(36)31(38)35-20(2)5-6-21(35)3)17-25(19)30(37)34-13-11-23(12-14-34)16-22-7-9-24(32)10-8-22;1-6-34(19(2)3)30(37)28(35)26-18-32(5)27-15-20(4)24(17-25(26)27)29(36)33-13-11-22(12-14-33)16-21-7-9-23(31)10-8-21;1-19-15-26-24(25(18-31(26)2)27(34)29(36)32-11-3-4-12-32)17-23(19)28(35)33-13-9-21(10-14-33)16-20-5-7-22(30)8-6-20;1-17(2)30-27(34)26(33)24-16-31(4)25-13-18(3)22(15-23(24)25)28(35)32-11-9-20(10-12-32)14-19-5-7-21(29)8-6-19/h6-9,16,18-19,22H,5,10-15,17H2,1-4H3;7-10,15,17-18,20-21,23H,5-6,11-14,16H2,1-4H3;7-10,15,17-19,22H,6,11-14,16H2,1-5H3;5-8,15,17-18,21H,3-4,9-14,16H2,1-2H3;5-8,13,15-17,20H,9-12,14H2,1-4H3,(H,30,34)
• InChIKey: VUDDROGAXXJMLD-UHFFFAOYSA-N
• XLogP: 24.72
• TPSA: 321.89 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 20
• Rotatable Bonds: 28
• Heavy Atoms: 184
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2508.09
LogP ≤ 5	24.72
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'diketo_group', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;1-(2,5-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;N-ethyl-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;1-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-pyrrolidin-1-ylethane-1,2-dione?

The IUPAC name of 1-(2,2-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;1-(2,5-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;N-ethyl-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;1-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-pyrrolidin-1-ylethane-1,2-dione (CID 161400196) is 1-(2,2-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;1-(2,5-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;N-ethyl-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;1-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-pyrrolidin-1-ylethane-1,2-dione.

What is the SMILES notation for 1-(2,2-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;1-(2,5-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;N-ethyl-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;1-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-pyrrolidin-1-ylethane-1,2-dione?

The canonical SMILES for 1-(2,2-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;1-(2,5-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;N-ethyl-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;1-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-pyrrolidin-1-ylethane-1,2-dione is CCN(C(=O)C(=O)c1cn(C)c2cc(C)c(C(=O)N3CCC(Cc4ccc(F)cc4)CC3)cc12)C(C)C.Cc1cc2c(cc1C(=O)N1CCC(Cc3ccc(F)cc3)CC1)c(C(=O)C(=O)N1C(C)CCC1C)cn2C.Cc1cc2c(cc1C(=O)N1CCC(Cc3ccc(F)cc3)CC1)c(C(=O)C(=O)N1CCCC1(C)C)cn2C.Cc1cc2c(cc1C(=O)N1CCC(Cc3ccc(F)cc3)CC1)c(C(=O)C(=O)N1CCCC1)cn2C.Cc1cc2c(cc1C(=O)N1CCC(Cc3ccc(F)cc3)CC1)c(C(=O)C(=O)NC(C)C)cn2C.

What is the InChIKey of 1-(2,2-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;1-(2,5-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;N-ethyl-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;1-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-pyrrolidin-1-ylethane-1,2-dione?

The InChIKey is VUDDROGAXXJMLD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C31H36FN3O3.C30H36FN3O3.C29H32FN3O3.C28H32FN3O3/c1-20-16-27-25(26(19-33(27)4)28(36)30(38)35-13-5-12-31(35,2)3)18-24(20)29(37)34-14-10-22(11-15-34)17-21-6-8-23(32)9-7-21;1-19-15-28-26(27(18-33(28)4)29(36)31(38)35-20(2)5-6-21(35)3)17-25(19)30(37)34-13-11-23(12-14-34)16-22-7-9-24(32)10-8-22;1-6-34(19(2)3)30(37)28(35)26-18-32(5)27-15-20(4)24(17-25(26)27)29(36)33-13-11-22(12-14-33)16-21-7-9-23(31)10-8-21;1-19-15-26-24(25(18-31(26)2)27(34)29(36)32-11-3-4-12-32)17-23(19)28(35)33-13-9-21(10-14-33)16-20-5-7-22(30)8-6-20;1-17(2)30-27(34)26(33)24-16-31(4)25-13-18(3)22(15-23(24)25)28(35)32-11-9-20(10-12-32)14-19-5-7-21(29)8-6-19/h6-9,16,18-19,22H,5,10-15,17H2,1-4H3;7-10,15,17-18,20-21,23H,5-6,11-14,16H2,1-4H3;7-10,15,17-19,22H,6,11-14,16H2,1-5H3;5-8,15,17-18,21H,3-4,9-14,16H2,1-2H3;5-8,13,15-17,20H,9-12,14H2,1-4H3,(H,30,34).

What are the key properties of 1-(2,2-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;1-(2,5-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;N-ethyl-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;1-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-pyrrolidin-1-ylethane-1,2-dione?

1-(2,2-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;1-(2,5-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;N-ethyl-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;1-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-pyrrolidin-1-ylethane-1,2-dione has a molecular weight of 2508.09 g/mol, XLogP of 24.72, 28 rotatable bonds, 1 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(2,2-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;1-(2,5-dimethylpyrrolidin-1-yl)-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]ethane-1,2-dione;N-ethyl-2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;2-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-oxo-N-propan-2-ylacetamide;1-[5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1,6-dimethylindol-3-yl]-2-pyrrolidin-1-ylethane-1,2-dione is sourced from PubChem (CID 161400196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).