[1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidin-4-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-3-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylethyl)piperidine-4-carboxamide

C119H121Cl4N17O8 — CID 158118083

IUPAC[1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidin-4-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-3-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylethyl)piperidine-4-carboxamide
SMILESO=C(NCCc1ccccn1)C1CCN(C(=O)c2cc3ccccc3n2Cc2ccc(Cl)cc2)CC1.O=C(NCCc1cccnc1)C1CCN(C(=O)c2cc3ccccc3n2Cc2ccc(Cl)cc2)CC1.O=C(NCCc1ccncc1)C1CCN(C(=O)c2cc3ccccc3n2Cc2ccc(Cl)cc2)CC1.O=C(c1cc2ccccc2n1Cc1ccc(Cl)cc1)N1CCC(C(=O)N2CCN(Cc3cccnc3)CC2)CC1
InChIInChI=1S/C32H34ClN5O2.3C29H29ClN4O2/c33-28-9-7-24(8-10-28)23-38-29-6-2-1-5-27(29)20-30(38)32(40)36-14-11-26(12-15-36)31(39)37-18-16-35(17-19-37)22-25-4-3-13-34-21-25;30-24-10-8-21(9-11-24)20-34-26-7-2-1-5-23(26)19-27(34)29(36)33-17-13-22(14-18-33)28(35)32-16-12-25-6-3-4-15-31-25;30-25-9-7-22(8-10-25)20-34-26-6-2-1-5-24(26)18-27(34)29(36)33-16-12-23(13-17-33)28(35)32-15-11-21-4-3-14-31-19-21;30-25-7-5-22(6-8-25)20-34-26-4-2-1-3-24(26)19-27(34)29(36)33-17-12-23(13-18-33)28(35)32-16-11-21-9-14-31-15-10-21/h1-10,13,20-21,26H,11-12,14-19,22-23H2;1-11,15,19,22H,12-14,16-18,20H2,(H,32,35);1-10,14,18-19,23H,11-13,15-17,20H2,(H,32,35);1-10,14-15,19,23H,11-13,16-18,20H2,(H,32,35)
InChIKeyFRGNVKTYSTTWSA-UHFFFAOYSA-N
MW2059.20 g/mol
LogP19.78
Rot. Bonds27

About [1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidin-4-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-3-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylethyl)piperidine-4-carboxamide

[1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidin-4-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-3-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylethyl)piperidine-4-carboxamide (PubChem CID 158118083) has the molecular formula C119H121Cl4N17O8 and a molecular weight of 2059.20 g/mol. Its IUPAC name is [1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidin-4-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-3-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylethyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name[1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidin-4-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-3-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylethyl)piperidine-4-carboxamide
PubChem CID158118083
Molecular FormulaC119H121Cl4N17O8
Molecular Weight2059.20 g/mol
Exact Mass2055.83
IUPAC Name[1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidin-4-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-3-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylethyl)piperidine-4-carboxamide
SMILESO=C(NCCc1ccccn1)C1CCN(C(=O)c2cc3ccccc3n2Cc2ccc(Cl)cc2)CC1.O=C(NCCc1cccnc1)C1CCN(C(=O)c2cc3ccccc3n2Cc2ccc(Cl)cc2)CC1.O=C(NCCc1ccncc1)C1CCN(C(=O)c2cc3ccccc3n2Cc2ccc(Cl)cc2)CC1.O=C(c1cc2ccccc2n1Cc1ccc(Cl)cc1)N1CCC(C(=O)N2CCN(Cc3cccnc3)CC2)CC1
InChIInChI=1S/C32H34ClN5O2.3C29H29ClN4O2/c33-28-9-7-24(8-10-28)23-38-29-6-2-1-5-27(29)20-30(38)32(40)36-14-11-26(12-15-36)31(39)37-18-16-35(17-19-37)22-25-4-3-13-34-21-25;30-24-10-8-21(9-11-24)20-34-26-7-2-1-5-23(26)19-27(34)29(36)33-17-13-22(14-18-33)28(35)32-16-12-25-6-3-4-15-31-25;30-25-9-7-22(8-10-25)20-34-26-6-2-1-5-24(26)18-27(34)29(36)33-16-12-23(13-17-33)28(35)32-15-11-21-4-3-14-31-19-21;30-25-7-5-22(6-8-25)20-34-26-4-2-1-3-24(26)19-27(34)29(36)33-17-12-23(13-18-33)28(35)32-16-11-21-9-14-31-15-10-21/h1-10,13,20-21,26H,11-12,14-19,22-23H2;1-11,15,19,22H,12-14,16-18,20H2,(H,32,35);1-10,14,18-19,23H,11-13,15-17,20H2,(H,32,35);1-10,14-15,19,23H,11-13,16-18,20H2,(H,32,35)
InChIKeyFRGNVKTYSTTWSA-UHFFFAOYSA-N
XLogP19.78
TPSA263.37 Ų
H-Bond Donors3
H-Bond Acceptors17
Rotatable Bonds27
Heavy Atoms148
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002059.20
LogP ≤ 519.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1017

Analyze [1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidin-4-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-3-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylethyl)piperidine-4-carboxamide with MolForge

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Related Compounds

spantide II
CID 16131028
1-(1-(4-chlorobenzyl)-1H-indole-2-carbonyl)-N-(2-(pyridin-4-yl)ethyl)piperidine-4-carboxamide
CID 66571217
1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-[(1R)-1-pyridin-4-ylethyl]piperidine-4-carboxamide
CID 72736887
1-[1-[(4-chlorophenyl)methyl]-6-fluoroindole-2-carbonyl]-N-(2-pyridin-4-ylethyl)piperidine-4-carboxamide
CID 72737230
1-[1-[(4-chlorophenyl)methyl]-5-fluoroindole-2-carbonyl]-N-(2-pyridin-4-ylethyl)piperidine-4-carboxamide
CID 72737423
1-(1-(4-chlorobenzyl)-1H-indole-2-carbonyl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide
CID 57386067
1-(1-(4-chlorobenzyl)-1H-indole-2-carbonyl)-N-(2-(pyridin-3-yl)ethyl)piperidine-4-carboxamide
CID 66571216
1-(1-(4-chlorobenzyl)-1H-indole-2-carbonyl)-N-(1-(pyridin-4-yl)ethyl)piperidine-4-carboxamide
CID 66571218
1-(1-(4-chlorobenzyl)-1H-indole-2-carbonyl)-N-(2-(pyridin-4-yl)propyl)piperidine-4-carboxamide
CID 66571338
1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylethyl)-3,6-dihydro-2H-pyridine-4-carboxamide
CID 164611882
1-(1-(4-chlorobenzyl)-1H-indole-2-carbonyl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide
CID 57385795
1-(1-(4-chlorobenzyl)-1H-indole-2-carbonyl)-N-(2-(pyridin-2-yl)ethyl)piperidine-4-carboxamide
CID 66571276

Frequently Asked Questions

What is the IUPAC name of [1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidin-4-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-3-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylethyl)piperidine-4-carboxamide?
The IUPAC name of [1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidin-4-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-3-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylethyl)piperidine-4-carboxamide (CID 158118083) is [1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidin-4-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-3-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylethyl)piperidine-4-carboxamide.
What is the SMILES notation for [1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidin-4-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-3-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylethyl)piperidine-4-carboxamide?
The canonical SMILES for [1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidin-4-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-3-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylethyl)piperidine-4-carboxamide is O=C(NCCc1ccccn1)C1CCN(C(=O)c2cc3ccccc3n2Cc2ccc(Cl)cc2)CC1.O=C(NCCc1cccnc1)C1CCN(C(=O)c2cc3ccccc3n2Cc2ccc(Cl)cc2)CC1.O=C(NCCc1ccncc1)C1CCN(C(=O)c2cc3ccccc3n2Cc2ccc(Cl)cc2)CC1.O=C(c1cc2ccccc2n1Cc1ccc(Cl)cc1)N1CCC(C(=O)N2CCN(Cc3cccnc3)CC2)CC1.
What is the InChIKey of [1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidin-4-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-3-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylethyl)piperidine-4-carboxamide?
The InChIKey is FRGNVKTYSTTWSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H34ClN5O2.3C29H29ClN4O2/c33-28-9-7-24(8-10-28)23-38-29-6-2-1-5-27(29)20-30(38)32(40)36-14-11-26(12-15-36)31(39)37-18-16-35(17-19-37)22-25-4-3-13-34-21-25;30-24-10-8-21(9-11-24)20-34-26-7-2-1-5-23(26)19-27(34)29(36)33-17-13-22(14-18-33)28(35)32-16-12-25-6-3-4-15-31-25;30-25-9-7-22(8-10-25)20-34-26-6-2-1-5-24(26)18-27(34)29(36)33-16-12-23(13-17-33)28(35)32-15-11-21-4-3-14-31-19-21;30-25-7-5-22(6-8-25)20-34-26-4-2-1-3-24(26)19-27(34)29(36)33-17-12-23(13-18-33)28(35)32-16-11-21-9-14-31-15-10-21/h1-10,13,20-21,26H,11-12,14-19,22-23H2;1-11,15,19,22H,12-14,16-18,20H2,(H,32,35);1-10,14,18-19,23H,11-13,15-17,20H2,(H,32,35);1-10,14-15,19,23H,11-13,16-18,20H2,(H,32,35).
What are the key properties of [1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidin-4-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-3-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylethyl)piperidine-4-carboxamide?
[1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidin-4-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-3-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylethyl)piperidine-4-carboxamide has a molecular weight of 2059.20 g/mol, XLogP of 19.78, 27 rotatable bonds, 3 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]piperidin-4-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-3-ylethyl)piperidine-4-carboxamide;1-[1-[(4-chlorophenyl)methyl]indole-2-carbonyl]-N-(2-pyridin-4-ylethyl)piperidine-4-carboxamide is sourced from PubChem (CID 158118083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).