1-[1-[3-(4-benzyl-4-hydroxypiperidin-1-yl)propyl]indol-3-yl]-2,2,2-trifluoroethanone;1-[1-[3-(4-benzylpiperidin-1-yl)-2-methylpropyl]indol-3-yl]ethanone;1-[1-[3-(4-benzylpiperidin-1-yl)propyl]indol-3-yl]propan-1-one;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone;1-[1-[3-[4-(4-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone

C125H145Cl2F3N10O10 — CID 160723336

About 1-[1-[3-(4-benzyl-4-hydroxypiperidin-1-yl)propyl]indol-3-yl]-2,2,2-trifluoroethanone;1-[1-[3-(4-benzylpiperidin-1-yl)-2-methylpropyl]indol-3-yl]ethanone;1-[1-[3-(4-benzylpiperidin-1-yl)propyl]indol-3-yl]propan-1-one;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone;1-[1-[3-[4-(4-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone

1-[1-[3-(4-benzyl-4-hydroxypiperidin-1-yl)propyl]indol-3-yl]-2,2,2-trifluoroethanone;1-[1-[3-(4-benzylpiperidin-1-yl)-2-methylpropyl]indol-3-yl]ethanone;1-[1-[3-(4-benzylpiperidin-1-yl)propyl]indol-3-yl]propan-1-one;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone;1-[1-[3-[4-(4-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone (PubChem CID 160723336) has the molecular formula C125H145Cl2F3N10O10 and a molecular weight of 2075.49 g/mol. Its IUPAC name is 1-[1-[3-(4-benzyl-4-hydroxypiperidin-1-yl)propyl]indol-3-yl]-2,2,2-trifluoroethanone;1-[1-[3-(4-benzylpiperidin-1-yl)-2-methylpropyl]indol-3-yl]ethanone;1-[1-[3-(4-benzylpiperidin-1-yl)propyl]indol-3-yl]propan-1-one;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone;1-[1-[3-[4-(4-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone.

Molecular Properties

• Compound Name: 1-[1-[3-(4-benzyl-4-hydroxypiperidin-1-yl)propyl]indol-3-yl]-2,2,2-trifluoroethanone;1-[1-[3-(4-benzylpiperidin-1-yl)-2-methylpropyl]indol-3-yl]ethanone;1-[1-[3-(4-benzylpiperidin-1-yl)propyl]indol-3-yl]propan-1-one;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone;1-[1-[3-[4-(4-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone
• PubChem CID: 160723336
• Molecular Formula: C125H145Cl2F3N10O10
• Molecular Weight: 2075.49 g/mol
• Exact Mass: 2073.05
• IUPAC Name: 1-[1-[3-(4-benzyl-4-hydroxypiperidin-1-yl)propyl]indol-3-yl]-2,2,2-trifluoroethanone;1-[1-[3-(4-benzylpiperidin-1-yl)-2-methylpropyl]indol-3-yl]ethanone;1-[1-[3-(4-benzylpiperidin-1-yl)propyl]indol-3-yl]propan-1-one;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone;1-[1-[3-[4-(4-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone
• SMILES: CC(=O)c1cn(CC(C)CN2CCC(Cc3ccccc3)CC2)c2ccccc12.CC(=O)c1cn(CC(O)CN2CCC(Oc3ccc(Cl)cc3)CC2)c2ccccc12.CC(=O)c1cn(CC(O)CN2CCC(Oc3ccccc3Cl)CC2)c2ccccc12.CCC(=O)c1cn(CCCN2CCC(Cc3ccccc3)CC2)c2ccccc12.O=C(c1cn(CCCN2CCC(O)(Cc3ccccc3)CC2)c2ccccc12)C(F)(F)F
• InChI: InChI=1S/2C26H32N2O.C25H27F3N2O2.2C24H27ClN2O3/c1-20(18-28-19-25(21(2)29)24-10-6-7-11-26(24)28)17-27-14-12-23(13-15-27)16-22-8-4-3-5-9-22;1-2-26(29)24-20-28(25-12-7-6-11-23(24)25)16-8-15-27-17-13-22(14-18-27)19-21-9-4-3-5-10-21;26-25(27,28)23(31)21-18-30(22-10-5-4-9-20(21)22)14-6-13-29-15-11-24(32,12-16-29)17-19-7-2-1-3-8-19;1-17(28)21-16-27(23-8-4-2-6-20(21)23)15-18(29)14-26-12-10-19(11-13-26)30-24-9-5-3-7-22(24)25;1-17(28)23-16-27(24-5-3-2-4-22(23)24)15-19(29)14-26-12-10-21(11-13-26)30-20-8-6-18(25)7-9-20/h3-11,19-20,23H,12-18H2,1-2H3;3-7,9-12,20,22H,2,8,13-19H2,1H3;1-5,7-10,18,32H,6,11-17H2;2-9,16,18-19,29H,10-15H2,1H3;2-9,16,19,21,29H,10-15H2,1H3
• InChIKey: RTJQEJIPWOKVPI-UHFFFAOYSA-N
• XLogP: 24.66
• TPSA: 205.35 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 20
• Rotatable Bonds: 36
• Heavy Atoms: 150
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2075.49
LogP ≤ 5	24.66
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	20

Frequently Asked Questions

What is the IUPAC name of 1-[1-[3-(4-benzyl-4-hydroxypiperidin-1-yl)propyl]indol-3-yl]-2,2,2-trifluoroethanone;1-[1-[3-(4-benzylpiperidin-1-yl)-2-methylpropyl]indol-3-yl]ethanone;1-[1-[3-(4-benzylpiperidin-1-yl)propyl]indol-3-yl]propan-1-one;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone;1-[1-[3-[4-(4-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone?

The IUPAC name of 1-[1-[3-(4-benzyl-4-hydroxypiperidin-1-yl)propyl]indol-3-yl]-2,2,2-trifluoroethanone;1-[1-[3-(4-benzylpiperidin-1-yl)-2-methylpropyl]indol-3-yl]ethanone;1-[1-[3-(4-benzylpiperidin-1-yl)propyl]indol-3-yl]propan-1-one;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone;1-[1-[3-[4-(4-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone (CID 160723336) is 1-[1-[3-(4-benzyl-4-hydroxypiperidin-1-yl)propyl]indol-3-yl]-2,2,2-trifluoroethanone;1-[1-[3-(4-benzylpiperidin-1-yl)-2-methylpropyl]indol-3-yl]ethanone;1-[1-[3-(4-benzylpiperidin-1-yl)propyl]indol-3-yl]propan-1-one;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone;1-[1-[3-[4-(4-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone.

What is the SMILES notation for 1-[1-[3-(4-benzyl-4-hydroxypiperidin-1-yl)propyl]indol-3-yl]-2,2,2-trifluoroethanone;1-[1-[3-(4-benzylpiperidin-1-yl)-2-methylpropyl]indol-3-yl]ethanone;1-[1-[3-(4-benzylpiperidin-1-yl)propyl]indol-3-yl]propan-1-one;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone;1-[1-[3-[4-(4-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone?

The canonical SMILES for 1-[1-[3-(4-benzyl-4-hydroxypiperidin-1-yl)propyl]indol-3-yl]-2,2,2-trifluoroethanone;1-[1-[3-(4-benzylpiperidin-1-yl)-2-methylpropyl]indol-3-yl]ethanone;1-[1-[3-(4-benzylpiperidin-1-yl)propyl]indol-3-yl]propan-1-one;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone;1-[1-[3-[4-(4-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone is CC(=O)c1cn(CC(C)CN2CCC(Cc3ccccc3)CC2)c2ccccc12.CC(=O)c1cn(CC(O)CN2CCC(Oc3ccc(Cl)cc3)CC2)c2ccccc12.CC(=O)c1cn(CC(O)CN2CCC(Oc3ccccc3Cl)CC2)c2ccccc12.CCC(=O)c1cn(CCCN2CCC(Cc3ccccc3)CC2)c2ccccc12.O=C(c1cn(CCCN2CCC(O)(Cc3ccccc3)CC2)c2ccccc12)C(F)(F)F.

What is the InChIKey of 1-[1-[3-(4-benzyl-4-hydroxypiperidin-1-yl)propyl]indol-3-yl]-2,2,2-trifluoroethanone;1-[1-[3-(4-benzylpiperidin-1-yl)-2-methylpropyl]indol-3-yl]ethanone;1-[1-[3-(4-benzylpiperidin-1-yl)propyl]indol-3-yl]propan-1-one;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone;1-[1-[3-[4-(4-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone?

The InChIKey is RTJQEJIPWOKVPI-UHFFFAOYSA-N. The full InChI is InChI=1S/2C26H32N2O.C25H27F3N2O2.2C24H27ClN2O3/c1-20(18-28-19-25(21(2)29)24-10-6-7-11-26(24)28)17-27-14-12-23(13-15-27)16-22-8-4-3-5-9-22;1-2-26(29)24-20-28(25-12-7-6-11-23(24)25)16-8-15-27-17-13-22(14-18-27)19-21-9-4-3-5-10-21;26-25(27,28)23(31)21-18-30(22-10-5-4-9-20(21)22)14-6-13-29-15-11-24(32,12-16-29)17-19-7-2-1-3-8-19;1-17(28)21-16-27(23-8-4-2-6-20(21)23)15-18(29)14-26-12-10-19(11-13-26)30-24-9-5-3-7-22(24)25;1-17(28)23-16-27(24-5-3-2-4-22(23)24)15-19(29)14-26-12-10-21(11-13-26)30-20-8-6-18(25)7-9-20/h3-11,19-20,23H,12-18H2,1-2H3;3-7,9-12,20,22H,2,8,13-19H2,1H3;1-5,7-10,18,32H,6,11-17H2;2-9,16,18-19,29H,10-15H2,1H3;2-9,16,19,21,29H,10-15H2,1H3.

What are the key properties of 1-[1-[3-(4-benzyl-4-hydroxypiperidin-1-yl)propyl]indol-3-yl]-2,2,2-trifluoroethanone;1-[1-[3-(4-benzylpiperidin-1-yl)-2-methylpropyl]indol-3-yl]ethanone;1-[1-[3-(4-benzylpiperidin-1-yl)propyl]indol-3-yl]propan-1-one;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone;1-[1-[3-[4-(4-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone?

1-[1-[3-(4-benzyl-4-hydroxypiperidin-1-yl)propyl]indol-3-yl]-2,2,2-trifluoroethanone;1-[1-[3-(4-benzylpiperidin-1-yl)-2-methylpropyl]indol-3-yl]ethanone;1-[1-[3-(4-benzylpiperidin-1-yl)propyl]indol-3-yl]propan-1-one;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone;1-[1-[3-[4-(4-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone has a molecular weight of 2075.49 g/mol, XLogP of 24.66, 36 rotatable bonds, 3 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[1-[3-(4-benzyl-4-hydroxypiperidin-1-yl)propyl]indol-3-yl]-2,2,2-trifluoroethanone;1-[1-[3-(4-benzylpiperidin-1-yl)-2-methylpropyl]indol-3-yl]ethanone;1-[1-[3-(4-benzylpiperidin-1-yl)propyl]indol-3-yl]propan-1-one;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone;1-[1-[3-[4-(4-chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone is sourced from PubChem (CID 160723336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).