C57H106N4O8 — CID 160634307
(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 10-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-10-oxodecanoate;(2,2,6,6-tetramethylpiperidin-4-yl) 10-oxo-10-(1,2,2,6,6-pentamethylpiperidin-4-yl)decanoate (PubChem CID 160634307) has the molecular formula C57H106N4O8 and a molecular weight of 975.49 g/mol. Its IUPAC name is (1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 10-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-10-oxodecanoate;(2,2,6,6-tetramethylpiperidin-4-yl) 10-oxo-10-(1,2,2,6,6-pentamethylpiperidin-4-yl)decanoate.
| Compound Name | (1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 10-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-10-oxodecanoate;(2,2,6,6-tetramethylpiperidin-4-yl) 10-oxo-10-(1,2,2,6,6-pentamethylpiperidin-4-yl)decanoate |
|---|---|
| PubChem CID | 160634307 |
| Molecular Formula | C57H106N4O8 |
| Molecular Weight | 975.49 g/mol |
| Exact Mass | 974.80 |
| IUPAC Name | (1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 10-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-10-oxodecanoate;(2,2,6,6-tetramethylpiperidin-4-yl) 10-oxo-10-(1,2,2,6,6-pentamethylpiperidin-4-yl)decanoate |
| SMILES | CC1(C)CC(OC(=O)CCCCCCCCC(=O)C2CC(C)(C)N(O)C(C)(C)C2)CC(C)(C)N1O.CN1C(C)(C)CC(C(=O)CCCCCCCCC(=O)OC2CC(C)(C)NC(C)(C)C2)CC1(C)C |
| InChI | InChI=1S/C29H54N2O3.C28H52N2O5/c1-26(2)20-23(21-27(3,4)30-26)34-25(33)17-15-13-11-10-12-14-16-24(32)22-18-28(5,6)31(9)29(7,8)19-22;1-25(2)17-21(18-26(3,4)29(25)33)23(31)15-13-11-9-10-12-14-16-24(32)35-22-19-27(5,6)30(34)28(7,8)20-22/h22-23,30H,10-21H2,1-9H3;21-22,33-34H,9-20H2,1-8H3 |
| InChIKey | GUZOYKXYFFHMBH-UHFFFAOYSA-N |
| XLogP | 12.72 |
| TPSA | 148.95 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 12 |
| Rotatable Bonds | 22 |
| Heavy Atoms | 69 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 975.49 |
| LogP ≤ 5 | 12.72 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 12 |
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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