C95H177N7O12 — CID 158514926
bis(1,2,2,6,6-pentamethylpiperidin-4-yl) decanedioate;bis(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;3-dodecyl-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione;(2,2,6,6-tetramethylpiperidin-4-yl) propanoate (PubChem CID 158514926) has the molecular formula C95H177N7O12 and a molecular weight of 1609.50 g/mol. Its IUPAC name is bis(1,2,2,6,6-pentamethylpiperidin-4-yl) decanedioate;bis(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;3-dodecyl-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione;(2,2,6,6-tetramethylpiperidin-4-yl) propanoate.
| Compound Name | bis(1,2,2,6,6-pentamethylpiperidin-4-yl) decanedioate;bis(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;3-dodecyl-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione;(2,2,6,6-tetramethylpiperidin-4-yl) propanoate |
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| PubChem CID | 158514926 |
| Molecular Formula | C95H177N7O12 |
| Molecular Weight | 1609.50 g/mol |
| Exact Mass | 1608.35 |
| IUPAC Name | bis(1,2,2,6,6-pentamethylpiperidin-4-yl) decanedioate;bis(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;3-dodecyl-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione;(2,2,6,6-tetramethylpiperidin-4-yl) propanoate |
| SMILES | CC1(C)CC(OC(=O)CCCCCCCCC(=O)OC2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1.CCC(=O)OC1CC(C)(C)NC(C)(C)C1.CCCCCCCCCCCCC1CC(=O)N(C2CC(C)(C)NC(C)(C)C2)C1=O.CN1C(C)(C)CC(OC(=O)CCCCCCCCC(=O)OC2CC(C)(C)N(C)C(C)(C)C2)CC1(C)C |
| InChI | InChI=1S/C30H56N2O4.C28H52N2O4.C25H46N2O2.C12H23NO2/c1-27(2)19-23(20-28(3,4)31(27)9)35-25(33)17-15-13-11-12-14-16-18-26(34)36-24-21-29(5,6)32(10)30(7,8)22-24;1-25(2)17-21(18-26(3,4)29-25)33-23(31)15-13-11-9-10-12-14-16-24(32)34-22-19-27(5,6)30-28(7,8)20-22;1-6-7-8-9-10-11-12-13-14-15-16-20-17-22(28)27(23(20)29)21-18-24(2,3)26-25(4,5)19-21;1-6-10(14)15-9-7-11(2,3)13-12(4,5)8-9/h23-24H,11-22H2,1-10H3;21-22,29-30H,9-20H2,1-8H3;20-21,26H,6-19H2,1-5H3;9,13H,6-8H2,1-5H3 |
| InChIKey | PGRQDVNXAMUAGE-UHFFFAOYSA-N |
| XLogP | 20.54 |
| TPSA | 223.48 Ų |
| H-Bond Donors | 4 |
| H-Bond Acceptors | 18 |
| Rotatable Bonds | 36 |
| Heavy Atoms | 114 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1609.50 |
| LogP ≤ 5 | 20.54 |
| H-Bond Donors ≤ 5 | 4 |
| H-Bond Acceptors ≤ 10 | 18 |
| Structural Alerts | {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'} |
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