N-benzyl-1-(1-benzylindole-2-carbonyl)-N-methylpiperidine-4-carboxamide;N-[2-(4-chlorophenyl)ethyl]-1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-[2-(4-propan-2-ylphenyl)ethyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylpropyl)piperidine-4-carboxamide

C123H127Cl4N13O8 — CID 160648289

IUPACN-benzyl-1-(1-benzylindole-2-carbonyl)-N-methylpiperidine-4-carboxamide;N-[2-(4-chlorophenyl)ethyl]-1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-[2-(4-propan-2-ylphenyl)ethyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylpropyl)piperidine-4-carboxamide
SMILESCC(C)c1ccc(CCNC(=O)C2CCN(C(=O)c3cc4ccccc4n3Cc3ccc(Cl)cc3)CC2)cc1.CC(CNC(=O)C1CCN(C(=O)c2cc3ccccc3n2Cc2ccc(Cl)cc2)CC1)c1ccncc1.CN(Cc1ccccc1)C(=O)C1CCN(C(=O)c2cc3ccccc3n2Cc2ccccc2)CC1.O=C(NCCc1ccc(Cl)cc1)C1CCN(C(=O)c2cc3ccccc3n2Cc2ccc(Cl)cc2)CC1
InChIInChI=1S/C33H36ClN3O2.C30H29Cl2N3O2.C30H31ClN4O2.C30H31N3O2/c1-23(2)26-11-7-24(8-12-26)15-18-35-32(38)27-16-19-36(20-17-27)33(39)31-21-28-5-3-4-6-30(28)37(31)22-25-9-13-29(34)14-10-25;31-25-9-5-21(6-10-25)13-16-33-29(36)23-14-17-34(18-15-23)30(37)28-19-24-3-1-2-4-27(24)35(28)20-22-7-11-26(32)12-8-22;1-21(23-10-14-32-15-11-23)19-33-29(36)24-12-16-34(17-13-24)30(37)28-18-25-4-2-3-5-27(25)35(28)20-22-6-8-26(31)9-7-22;1-31(21-23-10-4-2-5-11-23)29(34)25-16-18-32(19-17-25)30(35)28-20-26-14-8-9-15-27(26)33(28)22-24-12-6-3-7-13-24/h3-14,21,23,27H,15-20,22H2,1-2H3,(H,35,38);1-12,19,23H,13-18,20H2,(H,33,36);2-11,14-15,18,21,24H,12-13,16-17,19-20H2,1H3,(H,33,36);2-15,20,25H,16-19,21-22H2,1H3
InChIKeyRKBRXINCXWQTMR-UHFFFAOYSA-N
MW2057.26 g/mol
LogP23.60
Rot. Bonds28

About N-benzyl-1-(1-benzylindole-2-carbonyl)-N-methylpiperidine-4-carboxamide;N-[2-(4-chlorophenyl)ethyl]-1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-[2-(4-propan-2-ylphenyl)ethyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylpropyl)piperidine-4-carboxamide

N-benzyl-1-(1-benzylindole-2-carbonyl)-N-methylpiperidine-4-carboxamide;N-[2-(4-chlorophenyl)ethyl]-1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-[2-(4-propan-2-ylphenyl)ethyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylpropyl)piperidine-4-carboxamide (PubChem CID 160648289) has the molecular formula C123H127Cl4N13O8 and a molecular weight of 2057.26 g/mol. Its IUPAC name is N-benzyl-1-(1-benzylindole-2-carbonyl)-N-methylpiperidine-4-carboxamide;N-[2-(4-chlorophenyl)ethyl]-1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-[2-(4-propan-2-ylphenyl)ethyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylpropyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-benzyl-1-(1-benzylindole-2-carbonyl)-N-methylpiperidine-4-carboxamide;N-[2-(4-chlorophenyl)ethyl]-1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-[2-(4-propan-2-ylphenyl)ethyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylpropyl)piperidine-4-carboxamide
PubChem CID160648289
Molecular FormulaC123H127Cl4N13O8
Molecular Weight2057.26 g/mol
Exact Mass2053.87
IUPAC NameN-benzyl-1-(1-benzylindole-2-carbonyl)-N-methylpiperidine-4-carboxamide;N-[2-(4-chlorophenyl)ethyl]-1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-[2-(4-propan-2-ylphenyl)ethyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylpropyl)piperidine-4-carboxamide
SMILESCC(C)c1ccc(CCNC(=O)C2CCN(C(=O)c3cc4ccccc4n3Cc3ccc(Cl)cc3)CC2)cc1.CC(CNC(=O)C1CCN(C(=O)c2cc3ccccc3n2Cc2ccc(Cl)cc2)CC1)c1ccncc1.CN(Cc1ccccc1)C(=O)C1CCN(C(=O)c2cc3ccccc3n2Cc2ccccc2)CC1.O=C(NCCc1ccc(Cl)cc1)C1CCN(C(=O)c2cc3ccccc3n2Cc2ccc(Cl)cc2)CC1
InChIInChI=1S/C33H36ClN3O2.C30H29Cl2N3O2.C30H31ClN4O2.C30H31N3O2/c1-23(2)26-11-7-24(8-12-26)15-18-35-32(38)27-16-19-36(20-17-27)33(39)31-21-28-5-3-4-6-30(28)37(31)22-25-9-13-29(34)14-10-25;31-25-9-5-21(6-10-25)13-16-33-29(36)23-14-17-34(18-15-23)30(37)28-19-24-3-1-2-4-27(24)35(28)20-22-7-11-26(32)12-8-22;1-21(23-10-14-32-15-11-23)19-33-29(36)24-12-16-34(17-13-24)30(37)28-18-25-4-2-3-5-27(25)35(28)20-22-6-8-26(31)9-7-22;1-31(21-23-10-4-2-5-11-23)29(34)25-16-18-32(19-17-25)30(35)28-20-26-14-8-9-15-27(26)33(28)22-24-12-6-3-7-13-24/h3-14,21,23,27H,15-20,22H2,1-2H3,(H,35,38);1-12,19,23H,13-18,20H2,(H,33,36);2-11,14-15,18,21,24H,12-13,16-17,19-20H2,1H3,(H,33,36);2-15,20,25H,16-19,21-22H2,1H3
InChIKeyRKBRXINCXWQTMR-UHFFFAOYSA-N
XLogP23.60
TPSA221.46 Ų
H-Bond Donors3
H-Bond Acceptors13
Rotatable Bonds28
Heavy Atoms148
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002057.26
LogP ≤ 523.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1013

Analyze N-benzyl-1-(1-benzylindole-2-carbonyl)-N-methylpiperidine-4-carboxamide;N-[2-(4-chlorophenyl)ethyl]-1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-[2-(4-propan-2-ylphenyl)ethyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylpropyl)piperidine-4-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-1-(1-benzylindole-2-carbonyl)-N-methylpiperidine-4-carboxamide;N-[2-(4-chlorophenyl)ethyl]-1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-[2-(4-propan-2-ylphenyl)ethyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylpropyl)piperidine-4-carboxamide?
The IUPAC name of N-benzyl-1-(1-benzylindole-2-carbonyl)-N-methylpiperidine-4-carboxamide;N-[2-(4-chlorophenyl)ethyl]-1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-[2-(4-propan-2-ylphenyl)ethyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylpropyl)piperidine-4-carboxamide (CID 160648289) is N-benzyl-1-(1-benzylindole-2-carbonyl)-N-methylpiperidine-4-carboxamide;N-[2-(4-chlorophenyl)ethyl]-1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-[2-(4-propan-2-ylphenyl)ethyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylpropyl)piperidine-4-carboxamide.
What is the SMILES notation for N-benzyl-1-(1-benzylindole-2-carbonyl)-N-methylpiperidine-4-carboxamide;N-[2-(4-chlorophenyl)ethyl]-1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-[2-(4-propan-2-ylphenyl)ethyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylpropyl)piperidine-4-carboxamide?
The canonical SMILES for N-benzyl-1-(1-benzylindole-2-carbonyl)-N-methylpiperidine-4-carboxamide;N-[2-(4-chlorophenyl)ethyl]-1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-[2-(4-propan-2-ylphenyl)ethyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylpropyl)piperidine-4-carboxamide is CC(C)c1ccc(CCNC(=O)C2CCN(C(=O)c3cc4ccccc4n3Cc3ccc(Cl)cc3)CC2)cc1.CC(CNC(=O)C1CCN(C(=O)c2cc3ccccc3n2Cc2ccc(Cl)cc2)CC1)c1ccncc1.CN(Cc1ccccc1)C(=O)C1CCN(C(=O)c2cc3ccccc3n2Cc2ccccc2)CC1.O=C(NCCc1ccc(Cl)cc1)C1CCN(C(=O)c2cc3ccccc3n2Cc2ccc(Cl)cc2)CC1.
What is the InChIKey of N-benzyl-1-(1-benzylindole-2-carbonyl)-N-methylpiperidine-4-carboxamide;N-[2-(4-chlorophenyl)ethyl]-1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-[2-(4-propan-2-ylphenyl)ethyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylpropyl)piperidine-4-carboxamide?
The InChIKey is RKBRXINCXWQTMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H36ClN3O2.C30H29Cl2N3O2.C30H31ClN4O2.C30H31N3O2/c1-23(2)26-11-7-24(8-12-26)15-18-35-32(38)27-16-19-36(20-17-27)33(39)31-21-28-5-3-4-6-30(28)37(31)22-25-9-13-29(34)14-10-25;31-25-9-5-21(6-10-25)13-16-33-29(36)23-14-17-34(18-15-23)30(37)28-19-24-3-1-2-4-27(24)35(28)20-22-7-11-26(32)12-8-22;1-21(23-10-14-32-15-11-23)19-33-29(36)24-12-16-34(17-13-24)30(37)28-18-25-4-2-3-5-27(25)35(28)20-22-6-8-26(31)9-7-22;1-31(21-23-10-4-2-5-11-23)29(34)25-16-18-32(19-17-25)30(35)28-20-26-14-8-9-15-27(26)33(28)22-24-12-6-3-7-13-24/h3-14,21,23,27H,15-20,22H2,1-2H3,(H,35,38);1-12,19,23H,13-18,20H2,(H,33,36);2-11,14-15,18,21,24H,12-13,16-17,19-20H2,1H3,(H,33,36);2-15,20,25H,16-19,21-22H2,1H3.
What are the key properties of N-benzyl-1-(1-benzylindole-2-carbonyl)-N-methylpiperidine-4-carboxamide;N-[2-(4-chlorophenyl)ethyl]-1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-[2-(4-propan-2-ylphenyl)ethyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylpropyl)piperidine-4-carboxamide?
N-benzyl-1-(1-benzylindole-2-carbonyl)-N-methylpiperidine-4-carboxamide;N-[2-(4-chlorophenyl)ethyl]-1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-[2-(4-propan-2-ylphenyl)ethyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylpropyl)piperidine-4-carboxamide has a molecular weight of 2057.26 g/mol, XLogP of 23.60, 28 rotatable bonds, 3 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-1-(1-benzylindole-2-carbonyl)-N-methylpiperidine-4-carboxamide;N-[2-(4-chlorophenyl)ethyl]-1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-[2-(4-propan-2-ylphenyl)ethyl]piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylpropyl)piperidine-4-carboxamide is sourced from PubChem (CID 160648289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).