1-[7-bromo-1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]-N-(2-methylpropyl)indole-3-carboxamide

C158H192Br3Cl2F2N15O15 — CID 158590961

About 1-[7-bromo-1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]-N-(2-methylpropyl)indole-3-carboxamide

1-[7-bromo-1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]-N-(2-methylpropyl)indole-3-carboxamide (PubChem CID 158590961) has the molecular formula C158H192Br3Cl2F2N15O15 and a molecular weight of 2889.98 g/mol. Its IUPAC name is 1-[7-bromo-1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]-N-(2-methylpropyl)indole-3-carboxamide.

Molecular Properties

• Compound Name: 1-[7-bromo-1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]-N-(2-methylpropyl)indole-3-carboxamide
• PubChem CID: 158590961
• Molecular Formula: C158H192Br3Cl2F2N15O15
• Molecular Weight: 2889.98 g/mol
• Exact Mass: 2884.16
• IUPAC Name: 1-[7-bromo-1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]-N-(2-methylpropyl)indole-3-carboxamide
• SMILES: CC(=O)c1cn(CCCN2CCC(Oc3ccc(F)cc3)CC2)c2c(Br)cccc12.CC(=O)c1cn(CCCN2CCC(Oc3ccccc3Cl)CC2)c2c(Br)cccc12.COc1cccc2c(C(=O)NCC(C)C)cn(CCCN3CCC(Oc4ccc(F)cc4)CC3)c12.COc1cccc2c(C(=O)NCC(C)C)cn(CCCN3CCC(Oc4ccccc4Cl)CC3)c12.COc1ccccc1C1CCN(CCCn2cc(C(=O)NCC(C)C)c3cccc(OC)c32)CC1.COc1ccccc1C1CCN(CCCn2cc(C(C)=O)c3cccc(Br)c32)CC1
• InChI: InChI=1S/C29H39N3O3.C28H36ClN3O3.C28H36FN3O3.C25H29BrN2O2.C24H26BrClN2O2.C24H26BrFN2O2/c1-21(2)19-30-29(33)25-20-32(28-24(25)10-7-12-27(28)35-4)16-8-15-31-17-13-22(14-18-31)23-9-5-6-11-26(23)34-3;1-20(2)18-30-28(33)23-19-32(27-22(23)8-6-11-26(27)34-3)15-7-14-31-16-12-21(13-17-31)35-25-10-5-4-9-24(25)29;1-20(2)18-30-28(33)25-19-32(27-24(25)6-4-7-26(27)34-3)15-5-14-31-16-12-23(13-17-31)35-22-10-8-21(29)9-11-22;1-18(29)22-17-28(25-21(22)8-5-9-23(25)26)14-6-13-27-15-11-19(12-16-27)20-7-3-4-10-24(20)30-2;1-17(29)20-16-28(24-19(20)6-4-7-21(24)25)13-5-12-27-14-10-18(11-15-27)30-23-9-3-2-8-22(23)26;1-17(29)22-16-28(24-21(22)4-2-5-23(24)25)13-3-12-27-14-10-20(11-15-27)30-19-8-6-18(26)7-9-19/h5-7,9-12,20-22H,8,13-19H2,1-4H3,(H,30,33);4-6,8-11,19-21H,7,12-18H2,1-3H3,(H,30,33);4,6-11,19-20,23H,5,12-18H2,1-3H3,(H,30,33);3-5,7-10,17,19H,6,11-16H2,1-2H3;2-4,6-9,16,18H,5,10-15H2,1H3;2,4-9,16,20H,3,10-15H2,1H3
• InChIKey: HULAACNRXSWMCF-UHFFFAOYSA-N
• XLogP: 33.80
• TPSA: 270.60 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 27
• Rotatable Bonds: 51
• Heavy Atoms: 195
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2889.98
LogP ≤ 5	33.80
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	27

Frequently Asked Questions

What is the IUPAC name of 1-[7-bromo-1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]-N-(2-methylpropyl)indole-3-carboxamide?

The IUPAC name of 1-[7-bromo-1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]-N-(2-methylpropyl)indole-3-carboxamide (CID 158590961) is 1-[7-bromo-1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]-N-(2-methylpropyl)indole-3-carboxamide.

What is the SMILES notation for 1-[7-bromo-1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]-N-(2-methylpropyl)indole-3-carboxamide?

The canonical SMILES for 1-[7-bromo-1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]-N-(2-methylpropyl)indole-3-carboxamide is CC(=O)c1cn(CCCN2CCC(Oc3ccc(F)cc3)CC2)c2c(Br)cccc12.CC(=O)c1cn(CCCN2CCC(Oc3ccccc3Cl)CC2)c2c(Br)cccc12.COc1cccc2c(C(=O)NCC(C)C)cn(CCCN3CCC(Oc4ccc(F)cc4)CC3)c12.COc1cccc2c(C(=O)NCC(C)C)cn(CCCN3CCC(Oc4ccccc4Cl)CC3)c12.COc1ccccc1C1CCN(CCCn2cc(C(=O)NCC(C)C)c3cccc(OC)c32)CC1.COc1ccccc1C1CCN(CCCn2cc(C(C)=O)c3cccc(Br)c32)CC1.

What is the InChIKey of 1-[7-bromo-1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]-N-(2-methylpropyl)indole-3-carboxamide?

The InChIKey is HULAACNRXSWMCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H39N3O3.C28H36ClN3O3.C28H36FN3O3.C25H29BrN2O2.C24H26BrClN2O2.C24H26BrFN2O2/c1-21(2)19-30-29(33)25-20-32(28-24(25)10-7-12-27(28)35-4)16-8-15-31-17-13-22(14-18-31)23-9-5-6-11-26(23)34-3;1-20(2)18-30-28(33)23-19-32(27-22(23)8-6-11-26(27)34-3)15-7-14-31-16-12-21(13-17-31)35-25-10-5-4-9-24(25)29;1-20(2)18-30-28(33)25-19-32(27-24(25)6-4-7-26(27)34-3)15-5-14-31-16-12-23(13-17-31)35-22-10-8-21(29)9-11-22;1-18(29)22-17-28(25-21(22)8-5-9-23(25)26)14-6-13-27-15-11-19(12-16-27)20-7-3-4-10-24(20)30-2;1-17(29)20-16-28(24-19(20)6-4-7-21(24)25)13-5-12-27-14-10-18(11-15-27)30-23-9-3-2-8-22(23)26;1-17(29)22-16-28(24-21(22)4-2-5-23(24)25)13-3-12-27-14-10-20(11-15-27)30-19-8-6-18(26)7-9-19/h5-7,9-12,20-22H,8,13-19H2,1-4H3,(H,30,33);4-6,8-11,19-21H,7,12-18H2,1-3H3,(H,30,33);4,6-11,19-20,23H,5,12-18H2,1-3H3,(H,30,33);3-5,7-10,17,19H,6,11-16H2,1-2H3;2-4,6-9,16,18H,5,10-15H2,1H3;2,4-9,16,20H,3,10-15H2,1H3.

What are the key properties of 1-[7-bromo-1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]-N-(2-methylpropyl)indole-3-carboxamide?

1-[7-bromo-1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]-N-(2-methylpropyl)indole-3-carboxamide has a molecular weight of 2889.98 g/mol, XLogP of 33.80, 51 rotatable bonds, 3 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[7-bromo-1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[7-bromo-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]-N-(2-methylpropyl)indole-3-carboxamide is sourced from PubChem (CID 158590961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).