2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N',N'-dimethyl-2-oxoacetohydrazide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,2-dimethylpyrrolidin-1-yl)ethane-1,2-dione;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,5-dimethylpyrrolidin-1-yl)ethane-1,2-dione;2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N-ethyl-N-(2-methoxyethyl)-2-oxoacetamide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-piperidin-1-ylethane-1,2-dione

C144H158Cl5F5N16O16 — CID 158536623

About 2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N',N'-dimethyl-2-oxoacetohydrazide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,2-dimethylpyrrolidin-1-yl)ethane-1,2-dione;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,5-dimethylpyrrolidin-1-yl)ethane-1,2-dione;2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N-ethyl-N-(2-methoxyethyl)-2-oxoacetamide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-piperidin-1-ylethane-1,2-dione

2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N',N'-dimethyl-2-oxoacetohydrazide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,2-dimethylpyrrolidin-1-yl)ethane-1,2-dione;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,5-dimethylpyrrolidin-1-yl)ethane-1,2-dione;2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N-ethyl-N-(2-methoxyethyl)-2-oxoacetamide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-piperidin-1-ylethane-1,2-dione (PubChem CID 158536623) has the molecular formula C144H158Cl5F5N16O16 and a molecular weight of 2641.20 g/mol. Its IUPAC name is 2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N',N'-dimethyl-2-oxoacetohydrazide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,2-dimethylpyrrolidin-1-yl)ethane-1,2-dione;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,5-dimethylpyrrolidin-1-yl)ethane-1,2-dione;2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N-ethyl-N-(2-methoxyethyl)-2-oxoacetamide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-piperidin-1-ylethane-1,2-dione.

Molecular Properties

• Compound Name: 2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N',N'-dimethyl-2-oxoacetohydrazide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,2-dimethylpyrrolidin-1-yl)ethane-1,2-dione;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,5-dimethylpyrrolidin-1-yl)ethane-1,2-dione;2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N-ethyl-N-(2-methoxyethyl)-2-oxoacetamide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-piperidin-1-ylethane-1,2-dione
• PubChem CID: 158536623
• Molecular Formula: C144H158Cl5F5N16O16
• Molecular Weight: 2641.20 g/mol
• Exact Mass: 2637.04
• IUPAC Name: 2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N',N'-dimethyl-2-oxoacetohydrazide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,2-dimethylpyrrolidin-1-yl)ethane-1,2-dione;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,5-dimethylpyrrolidin-1-yl)ethane-1,2-dione;2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N-ethyl-N-(2-methoxyethyl)-2-oxoacetamide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-piperidin-1-ylethane-1,2-dione
• SMILES: CC1CCC(C)N1C(=O)C(=O)c1cn(C)c2cc(Cl)c(C(=O)N3CCC(Cc4ccc(F)cc4)CC3)cc12.CCN(CCOC)C(=O)C(=O)c1cn(C)c2cc(Cl)c(C(=O)N3CCC(Cc4ccc(F)cc4)CC3)cc12.CN(C)NC(=O)C(=O)c1cn(C)c2cc(Cl)c(C(=O)N3CCC(Cc4ccc(F)cc4)CC3)cc12.Cn1cc(C(=O)C(=O)N2CCCC2(C)C)c2cc(C(=O)N3CCC(Cc4ccc(F)cc4)CC3)c(Cl)cc21.Cn1cc(C(=O)C(=O)N2CCCCC2)c2cc(C(=O)N3CCC(Cc4ccc(F)cc4)CC3)c(Cl)cc21
• InChI: InChI=1S/2C30H33ClFN3O3.C29H33ClFN3O4.C29H31ClFN3O3.C26H28ClFN4O3/c1-30(2)11-4-12-35(30)29(38)27(36)24-18-33(3)26-17-25(31)23(16-22(24)26)28(37)34-13-9-20(10-14-34)15-19-5-7-21(32)8-6-19;1-18-4-5-19(2)35(18)30(38)28(36)25-17-33(3)27-16-26(31)24(15-23(25)27)29(37)34-12-10-21(11-13-34)14-20-6-8-22(32)9-7-20;1-4-33(13-14-38-3)29(37)27(35)24-18-32(2)26-17-25(30)23(16-22(24)26)28(36)34-11-9-20(10-12-34)15-19-5-7-21(31)8-6-19;1-32-18-24(27(35)29(37)33-11-3-2-4-12-33)22-16-23(25(30)17-26(22)32)28(36)34-13-9-20(10-14-34)15-19-5-7-21(31)8-6-19;1-30(2)29-25(34)24(33)21-15-31(3)23-14-22(27)20(13-19(21)23)26(35)32-10-8-17(9-11-32)12-16-4-6-18(28)7-5-16/h5-8,16-18,20H,4,9-15H2,1-3H3;6-9,15-19,21H,4-5,10-14H2,1-3H3;5-8,16-18,20H,4,9-15H2,1-3H3;5-8,16-18,20H,2-4,9-15H2,1H3;4-7,13-15,17H,8-12H2,1-3H3,(H,29,34)
• InChIKey: HOADSRMCRZDCLB-UHFFFAOYSA-N
• XLogP: 25.14
• TPSA: 334.36 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 22
• Rotatable Bonds: 30
• Heavy Atoms: 186
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2641.20
LogP ≤ 5	25.14
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N',N'-dimethyl-2-oxoacetohydrazide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,2-dimethylpyrrolidin-1-yl)ethane-1,2-dione;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,5-dimethylpyrrolidin-1-yl)ethane-1,2-dione;2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N-ethyl-N-(2-methoxyethyl)-2-oxoacetamide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-piperidin-1-ylethane-1,2-dione?

The IUPAC name of 2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N',N'-dimethyl-2-oxoacetohydrazide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,2-dimethylpyrrolidin-1-yl)ethane-1,2-dione;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,5-dimethylpyrrolidin-1-yl)ethane-1,2-dione;2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N-ethyl-N-(2-methoxyethyl)-2-oxoacetamide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-piperidin-1-ylethane-1,2-dione (CID 158536623) is 2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N',N'-dimethyl-2-oxoacetohydrazide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,2-dimethylpyrrolidin-1-yl)ethane-1,2-dione;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,5-dimethylpyrrolidin-1-yl)ethane-1,2-dione;2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N-ethyl-N-(2-methoxyethyl)-2-oxoacetamide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-piperidin-1-ylethane-1,2-dione.

What is the SMILES notation for 2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N',N'-dimethyl-2-oxoacetohydrazide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,2-dimethylpyrrolidin-1-yl)ethane-1,2-dione;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,5-dimethylpyrrolidin-1-yl)ethane-1,2-dione;2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N-ethyl-N-(2-methoxyethyl)-2-oxoacetamide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-piperidin-1-ylethane-1,2-dione?

The canonical SMILES for 2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N',N'-dimethyl-2-oxoacetohydrazide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,2-dimethylpyrrolidin-1-yl)ethane-1,2-dione;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,5-dimethylpyrrolidin-1-yl)ethane-1,2-dione;2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N-ethyl-N-(2-methoxyethyl)-2-oxoacetamide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-piperidin-1-ylethane-1,2-dione is CC1CCC(C)N1C(=O)C(=O)c1cn(C)c2cc(Cl)c(C(=O)N3CCC(Cc4ccc(F)cc4)CC3)cc12.CCN(CCOC)C(=O)C(=O)c1cn(C)c2cc(Cl)c(C(=O)N3CCC(Cc4ccc(F)cc4)CC3)cc12.CN(C)NC(=O)C(=O)c1cn(C)c2cc(Cl)c(C(=O)N3CCC(Cc4ccc(F)cc4)CC3)cc12.Cn1cc(C(=O)C(=O)N2CCCC2(C)C)c2cc(C(=O)N3CCC(Cc4ccc(F)cc4)CC3)c(Cl)cc21.Cn1cc(C(=O)C(=O)N2CCCCC2)c2cc(C(=O)N3CCC(Cc4ccc(F)cc4)CC3)c(Cl)cc21.

What is the InChIKey of 2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N',N'-dimethyl-2-oxoacetohydrazide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,2-dimethylpyrrolidin-1-yl)ethane-1,2-dione;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,5-dimethylpyrrolidin-1-yl)ethane-1,2-dione;2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N-ethyl-N-(2-methoxyethyl)-2-oxoacetamide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-piperidin-1-ylethane-1,2-dione?

The InChIKey is HOADSRMCRZDCLB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C30H33ClFN3O3.C29H33ClFN3O4.C29H31ClFN3O3.C26H28ClFN4O3/c1-30(2)11-4-12-35(30)29(38)27(36)24-18-33(3)26-17-25(31)23(16-22(24)26)28(37)34-13-9-20(10-14-34)15-19-5-7-21(32)8-6-19;1-18-4-5-19(2)35(18)30(38)28(36)25-17-33(3)27-16-26(31)24(15-23(25)27)29(37)34-12-10-21(11-13-34)14-20-6-8-22(32)9-7-20;1-4-33(13-14-38-3)29(37)27(35)24-18-32(2)26-17-25(30)23(16-22(24)26)28(36)34-11-9-20(10-12-34)15-19-5-7-21(31)8-6-19;1-32-18-24(27(35)29(37)33-11-3-2-4-12-33)22-16-23(25(30)17-26(22)32)28(36)34-13-9-20(10-14-34)15-19-5-7-21(31)8-6-19;1-30(2)29-25(34)24(33)21-15-31(3)23-14-22(27)20(13-19(21)23)26(35)32-10-8-17(9-11-32)12-16-4-6-18(28)7-5-16/h5-8,16-18,20H,4,9-15H2,1-3H3;6-9,15-19,21H,4-5,10-14H2,1-3H3;5-8,16-18,20H,4,9-15H2,1-3H3;5-8,16-18,20H,2-4,9-15H2,1H3;4-7,13-15,17H,8-12H2,1-3H3,(H,29,34).

What are the key properties of 2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N',N'-dimethyl-2-oxoacetohydrazide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,2-dimethylpyrrolidin-1-yl)ethane-1,2-dione;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,5-dimethylpyrrolidin-1-yl)ethane-1,2-dione;2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N-ethyl-N-(2-methoxyethyl)-2-oxoacetamide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-piperidin-1-ylethane-1,2-dione?

2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N',N'-dimethyl-2-oxoacetohydrazide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,2-dimethylpyrrolidin-1-yl)ethane-1,2-dione;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,5-dimethylpyrrolidin-1-yl)ethane-1,2-dione;2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N-ethyl-N-(2-methoxyethyl)-2-oxoacetamide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-piperidin-1-ylethane-1,2-dione has a molecular weight of 2641.20 g/mol, XLogP of 25.14, 30 rotatable bonds, 1 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N',N'-dimethyl-2-oxoacetohydrazide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,2-dimethylpyrrolidin-1-yl)ethane-1,2-dione;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-(2,5-dimethylpyrrolidin-1-yl)ethane-1,2-dione;2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N-ethyl-N-(2-methoxyethyl)-2-oxoacetamide;1-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-2-piperidin-1-ylethane-1,2-dione is sourced from PubChem (CID 158536623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).