C141H165N21O10 — CID 159821161
2-(4-acetyl-4-phenylpiperidin-1-yl)-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;N-[2-(4-hydroxyphenyl)-3-pyridin-3-ylpropyl]-2-(4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-8-yl)acetamide;N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-2-phenyl-3-pyridin-3-ylpropan-1-amine;2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;2-(4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-8-yl)-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide (PubChem CID 159821161) has the molecular formula C141H165N21O10 and a molecular weight of 2314.01 g/mol. Its IUPAC name is 2-(4-acetyl-4-phenylpiperidin-1-yl)-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;N-[2-(4-hydroxyphenyl)-3-pyridin-3-ylpropyl]-2-(4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-8-yl)acetamide;N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-2-phenyl-3-pyridin-3-ylpropan-1-amine;2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;2-(4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-8-yl)-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide.
| Compound Name | 2-(4-acetyl-4-phenylpiperidin-1-yl)-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;N-[2-(4-hydroxyphenyl)-3-pyridin-3-ylpropyl]-2-(4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-8-yl)acetamide;N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-2-phenyl-3-pyridin-3-ylpropan-1-amine;2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;2-(4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-8-yl)-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide |
|---|---|
| PubChem CID | 159821161 |
| Molecular Formula | C141H165N21O10 |
| Molecular Weight | 2314.01 g/mol |
| Exact Mass | 2312.30 |
| IUPAC Name | 2-(4-acetyl-4-phenylpiperidin-1-yl)-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;N-[2-(4-hydroxyphenyl)-3-pyridin-3-ylpropyl]-2-(4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-8-yl)acetamide;N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-2-phenyl-3-pyridin-3-ylpropan-1-amine;2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;2-(4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-8-yl)-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide |
| SMILES | CC(=O)C1(c2ccccc2)CCN(CC(=O)NCC(Cc2cccnc2)c2ccccc2)CC1.COc1ccccc1N1CCN(CC(=O)NCC(Cc2cccnc2)c2ccccc2)CC1.COc1ccccc1N1CCN(CCNCC(Cc2cccnc2)c2ccccc2)CC1.O=C(CN1CCC2(CC1)C(=O)NCN2c1ccccc1)NCC(Cc1cccnc1)c1ccc(O)cc1.O=C(CN1CCC2(CC1)C(=O)NCN2c1ccccc1)NCC(Cc1cccnc1)c1ccccc1 |
| InChI | InChI=1S/C29H33N5O3.C29H33N5O2.C29H33N3O2.C27H32N4O2.C27H34N4O/c35-26-10-8-23(9-11-26)24(17-22-5-4-14-30-18-22)19-31-27(36)20-33-15-12-29(13-16-33)28(37)32-21-34(29)25-6-2-1-3-7-25;35-27(31-20-25(24-9-3-1-4-10-24)18-23-8-7-15-30-19-23)21-33-16-13-29(14-17-33)28(36)32-22-34(29)26-11-5-2-6-12-26;1-23(33)29(27-12-6-3-7-13-27)14-17-32(18-15-29)22-28(34)31-21-26(25-10-4-2-5-11-25)19-24-9-8-16-30-20-24;1-33-26-12-6-5-11-25(26)31-16-14-30(15-17-31)21-27(32)29-20-24(23-9-3-2-4-10-23)18-22-8-7-13-28-19-22;1-32-27-12-6-5-11-26(27)31-18-16-30(17-19-31)15-14-29-22-25(24-9-3-2-4-10-24)20-23-8-7-13-28-21-23/h1-11,14,18,24,35H,12-13,15-17,19-21H2,(H,31,36)(H,32,37);1-12,15,19,25H,13-14,16-18,20-22H2,(H,31,35)(H,32,36);2-13,16,20,26H,14-15,17-19,21-22H2,1H3,(H,31,34);2-13,19,24H,14-18,20-21H2,1H3,(H,29,32);2-13,21,25,29H,14-20,22H2,1H3 |
| InChIKey | NMGHBBZIKCIBOX-UHFFFAOYSA-N |
| XLogP | 16.94 |
| TPSA | 336.00 Ų |
| H-Bond Donors | 8 |
| H-Bond Acceptors | 25 |
| Rotatable Bonds | 44 |
| Heavy Atoms | 172 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2314.01 |
| LogP ≤ 5 | 16.94 |
| H-Bond Donors ≤ 5 | 8 |
| H-Bond Acceptors ≤ 10 | 25 |
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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