[7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone

C124H131N15O12 — CID 158733456

IUPAC[7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone
SMILESCOc1cccc2c(C(=O)c3ccccc3)cn(CCCN3CCC(c4nc(-c5cccnc5)no4)CC3)c12.COc1cccc2c(C(=O)c3ccccc3)cn(CCCN3CCC(c4nc(-c5ccncc5)no4)CC3)c12.COc1cccc2c(C(=O)c3ccccc3)cn(CCCN3CCN(CCOc4ccccc4)CC3)c12.COc1ccccc1C1CCN(CCCn2cc(C(=O)c3ccccc3)c3cccc(OC)c32)CC1
InChIInChI=1S/2C31H31N5O3.C31H35N3O3.C31H34N2O3/c1-38-27-12-5-11-25-26(29(37)22-8-3-2-4-9-22)21-36(28(25)27)17-7-16-35-18-13-23(14-19-35)31-33-30(34-39-31)24-10-6-15-32-20-24;1-38-27-10-5-9-25-26(29(37)22-7-3-2-4-8-22)21-36(28(25)27)18-6-17-35-19-13-24(14-20-35)31-33-30(34-39-31)23-11-15-32-16-12-23;1-36-29-15-8-14-27-28(31(35)25-10-4-2-5-11-25)24-34(30(27)29)17-9-16-32-18-20-33(21-19-32)22-23-37-26-12-6-3-7-13-26;1-35-28-14-7-6-12-25(28)23-16-20-32(21-17-23)18-9-19-33-22-27(31(34)24-10-4-3-5-11-24)26-13-8-15-29(36-2)30(26)33/h2-6,8-12,15,20-21,23H,7,13-14,16-19H2,1H3;2-5,7-12,15-16,21,24H,6,13-14,17-20H2,1H3;2-8,10-15,24H,9,16-23H2,1H3;3-8,10-15,22-23H,9,16-21H2,1-2H3
InChIKeyILJNUHUWDMPAGZ-UHFFFAOYSA-N
MW2023.50 g/mol
LogP22.32
Rot. Bonds38

About [7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone

[7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone (PubChem CID 158733456) has the molecular formula C124H131N15O12 and a molecular weight of 2023.50 g/mol. Its IUPAC name is [7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone.

Molecular Properties

Compound Name[7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone
PubChem CID158733456
Molecular FormulaC124H131N15O12
Molecular Weight2023.50 g/mol
Exact Mass2022.01
IUPAC Name[7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone
SMILESCOc1cccc2c(C(=O)c3ccccc3)cn(CCCN3CCC(c4nc(-c5cccnc5)no4)CC3)c12.COc1cccc2c(C(=O)c3ccccc3)cn(CCCN3CCC(c4nc(-c5ccncc5)no4)CC3)c12.COc1cccc2c(C(=O)c3ccccc3)cn(CCCN3CCN(CCOc4ccccc4)CC3)c12.COc1ccccc1C1CCN(CCCn2cc(C(=O)c3ccccc3)c3cccc(OC)c32)CC1
InChIInChI=1S/2C31H31N5O3.C31H35N3O3.C31H34N2O3/c1-38-27-12-5-11-25-26(29(37)22-8-3-2-4-9-22)21-36(28(25)27)17-7-16-35-18-13-23(14-19-35)31-33-30(34-39-31)24-10-6-15-32-20-24;1-38-27-10-5-9-25-26(29(37)22-7-3-2-4-8-22)21-36(28(25)27)18-6-17-35-19-13-24(14-20-35)31-33-30(34-39-31)23-11-15-32-16-12-23;1-36-29-15-8-14-27-28(31(35)25-10-4-2-5-11-25)24-34(30(27)29)17-9-16-32-18-20-33(21-19-32)22-23-37-26-12-6-3-7-13-26;1-35-28-14-7-6-12-25(28)23-16-20-32(21-17-23)18-9-19-33-22-27(31(34)24-10-4-3-5-11-24)26-13-8-15-29(36-2)30(26)33/h2-6,8-12,15,20-21,23H,7,13-14,16-19H2,1H3;2-5,7-12,15-16,21,24H,6,13-14,17-20H2,1H3;2-8,10-15,24H,9,16-23H2,1H3;3-8,10-15,22-23H,9,16-21H2,1-2H3
InChIKeyILJNUHUWDMPAGZ-UHFFFAOYSA-N
XLogP22.32
TPSA263.20 Ų
H-Bond Donors
H-Bond Acceptors27
Rotatable Bonds38
Heavy Atoms151
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002023.50
LogP ≤ 522.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1027

Analyze [7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone with MolForge

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Frequently Asked Questions

What is the IUPAC name of [7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone?
The IUPAC name of [7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone (CID 158733456) is [7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone.
What is the SMILES notation for [7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone?
The canonical SMILES for [7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone is COc1cccc2c(C(=O)c3ccccc3)cn(CCCN3CCC(c4nc(-c5cccnc5)no4)CC3)c12.COc1cccc2c(C(=O)c3ccccc3)cn(CCCN3CCC(c4nc(-c5ccncc5)no4)CC3)c12.COc1cccc2c(C(=O)c3ccccc3)cn(CCCN3CCN(CCOc4ccccc4)CC3)c12.COc1ccccc1C1CCN(CCCn2cc(C(=O)c3ccccc3)c3cccc(OC)c32)CC1.
What is the InChIKey of [7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone?
The InChIKey is ILJNUHUWDMPAGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C31H31N5O3.C31H35N3O3.C31H34N2O3/c1-38-27-12-5-11-25-26(29(37)22-8-3-2-4-9-22)21-36(28(25)27)17-7-16-35-18-13-23(14-19-35)31-33-30(34-39-31)24-10-6-15-32-20-24;1-38-27-10-5-9-25-26(29(37)22-7-3-2-4-8-22)21-36(28(25)27)18-6-17-35-19-13-24(14-20-35)31-33-30(34-39-31)23-11-15-32-16-12-23;1-36-29-15-8-14-27-28(31(35)25-10-4-2-5-11-25)24-34(30(27)29)17-9-16-32-18-20-33(21-19-32)22-23-37-26-12-6-3-7-13-26;1-35-28-14-7-6-12-25(28)23-16-20-32(21-17-23)18-9-19-33-22-27(31(34)24-10-4-3-5-11-24)26-13-8-15-29(36-2)30(26)33/h2-6,8-12,15,20-21,23H,7,13-14,16-19H2,1H3;2-5,7-12,15-16,21,24H,6,13-14,17-20H2,1H3;2-8,10-15,24H,9,16-23H2,1H3;3-8,10-15,22-23H,9,16-21H2,1-2H3.
What are the key properties of [7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone?
[7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone has a molecular weight of 2023.50 g/mol, XLogP of 22.32, 38 rotatable bonds, 0 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for [7-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone;[7-methoxy-1-[3-[4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]indol-3-yl]-phenylmethanone is sourced from PubChem (CID 158733456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).