1-[7-chloro-1-[3-[4-(3-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone

C99H108Cl5N15O8 — CID 158954889

About 1-[7-chloro-1-[3-[4-(3-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone

1-[7-chloro-1-[3-[4-(3-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone (PubChem CID 158954889) has the molecular formula C99H108Cl5N15O8 and a molecular weight of 1813.31 g/mol. Its IUPAC name is 1-[7-chloro-1-[3-[4-(3-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone.

Molecular Properties

• Compound Name: 1-[7-chloro-1-[3-[4-(3-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone
• PubChem CID: 158954889
• Molecular Formula: C99H108Cl5N15O8
• Molecular Weight: 1813.31 g/mol
• Exact Mass: 1809.69
• IUPAC Name: 1-[7-chloro-1-[3-[4-(3-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone
• SMILES: CC(=O)c1cn(CCCN2CCC(Oc3cccc(Cl)c3)CC2)c2c(Cl)cccc12.CC(=O)c1cn(CCCN2CCC(c3nc(-c4cccnc4)no3)CC2)c2c(Cl)cccc12.CC(=O)c1cn(CCCN2CCC(c3nc(-c4ccncc4)no3)CC2)c2c(Cl)cccc12.CC(=O)c1cn(CCCN2CCN(CCOc3ccccc3)CC2)c2c(Cl)cccc12
• InChI: InChI=1S/2C25H26ClN5O2.C25H30ClN3O2.C24H26Cl2N2O2/c1-17(32)21-16-31(23-20(21)6-2-7-22(23)26)12-4-11-30-13-8-18(9-14-30)25-28-24(29-33-25)19-5-3-10-27-15-19;1-17(32)21-16-31(23-20(21)4-2-5-22(23)26)13-3-12-30-14-8-19(9-15-30)25-28-24(29-33-25)18-6-10-27-11-7-18;1-20(30)23-19-29(25-22(23)9-5-10-24(25)26)12-6-11-27-13-15-28(16-14-27)17-18-31-21-7-3-2-4-8-21;1-17(29)22-16-28(24-21(22)7-3-8-23(24)26)12-4-11-27-13-9-19(10-14-27)30-20-6-2-5-18(25)15-20/h2-3,5-7,10,15-16,18H,4,8-9,11-14H2,1H3;2,4-7,10-11,16,19H,3,8-9,12-15H2,1H3;2-5,7-10,19H,6,11-18H2,1H3;2-3,5-8,15-16,19H,4,9-14H2,1H3
• InChIKey: JLWMZLKLNOSCJR-UHFFFAOYSA-N
• XLogP: 21.09
• TPSA: 226.28 Ų
• H-Bond Acceptors: 23
• Rotatable Bonds: 30
• Heavy Atoms: 127
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1813.31
LogP ≤ 5	21.09
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	23

Frequently Asked Questions

What is the IUPAC name of 1-[7-chloro-1-[3-[4-(3-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone?

The IUPAC name of 1-[7-chloro-1-[3-[4-(3-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone (CID 158954889) is 1-[7-chloro-1-[3-[4-(3-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone.

What is the SMILES notation for 1-[7-chloro-1-[3-[4-(3-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone?

The canonical SMILES for 1-[7-chloro-1-[3-[4-(3-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone is CC(=O)c1cn(CCCN2CCC(Oc3cccc(Cl)c3)CC2)c2c(Cl)cccc12.CC(=O)c1cn(CCCN2CCC(c3nc(-c4cccnc4)no3)CC2)c2c(Cl)cccc12.CC(=O)c1cn(CCCN2CCC(c3nc(-c4ccncc4)no3)CC2)c2c(Cl)cccc12.CC(=O)c1cn(CCCN2CCN(CCOc3ccccc3)CC2)c2c(Cl)cccc12.

What is the InChIKey of 1-[7-chloro-1-[3-[4-(3-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone?

The InChIKey is JLWMZLKLNOSCJR-UHFFFAOYSA-N. The full InChI is InChI=1S/2C25H26ClN5O2.C25H30ClN3O2.C24H26Cl2N2O2/c1-17(32)21-16-31(23-20(21)6-2-7-22(23)26)12-4-11-30-13-8-18(9-14-30)25-28-24(29-33-25)19-5-3-10-27-15-19;1-17(32)21-16-31(23-20(21)4-2-5-22(23)26)13-3-12-30-14-8-19(9-15-30)25-28-24(29-33-25)18-6-10-27-11-7-18;1-20(30)23-19-29(25-22(23)9-5-10-24(25)26)12-6-11-27-13-15-28(16-14-27)17-18-31-21-7-3-2-4-8-21;1-17(29)22-16-28(24-21(22)7-3-8-23(24)26)12-4-11-27-13-9-19(10-14-27)30-20-6-2-5-18(25)15-20/h2-3,5-7,10,15-16,18H,4,8-9,11-14H2,1H3;2,4-7,10-11,16,19H,3,8-9,12-15H2,1H3;2-5,7-10,19H,6,11-18H2,1H3;2-3,5-8,15-16,19H,4,9-14H2,1H3.

What are the key properties of 1-[7-chloro-1-[3-[4-(3-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone?

1-[7-chloro-1-[3-[4-(3-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone has a molecular weight of 1813.31 g/mol, XLogP of 21.09, 30 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[7-chloro-1-[3-[4-(3-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-chloro-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]ethanone is sourced from PubChem (CID 158954889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).