C50H110N4O11 — CID 161062825
1-hydroxy-4-(2-methoxyethoxy)-2,2,6,6-tetramethylpiperidine;1-hydroxy-4-(3-methoxypropoxy)-2,2,6,6-tetramethylpiperidine;1-hydroxy-4-methoxy-2,2,6,6-tetramethylpiperidine;(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) acetate;methane (PubChem CID 161062825) has the molecular formula C50H110N4O11 and a molecular weight of 943.45 g/mol. Its IUPAC name is 1-hydroxy-4-(2-methoxyethoxy)-2,2,6,6-tetramethylpiperidine;1-hydroxy-4-(3-methoxypropoxy)-2,2,6,6-tetramethylpiperidine;1-hydroxy-4-methoxy-2,2,6,6-tetramethylpiperidine;(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) acetate;methane.
| Compound Name | 1-hydroxy-4-(2-methoxyethoxy)-2,2,6,6-tetramethylpiperidine;1-hydroxy-4-(3-methoxypropoxy)-2,2,6,6-tetramethylpiperidine;1-hydroxy-4-methoxy-2,2,6,6-tetramethylpiperidine;(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) acetate;methane |
|---|---|
| PubChem CID | 161062825 |
| Molecular Formula | C50H110N4O11 |
| Molecular Weight | 943.45 g/mol |
| Exact Mass | 942.82 |
| IUPAC Name | 1-hydroxy-4-(2-methoxyethoxy)-2,2,6,6-tetramethylpiperidine;1-hydroxy-4-(3-methoxypropoxy)-2,2,6,6-tetramethylpiperidine;1-hydroxy-4-methoxy-2,2,6,6-tetramethylpiperidine;(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) acetate;methane |
| SMILES | C.C.C.C.CC(=O)OC1CC(C)(C)N(O)C(C)(C)C1.COC1CC(C)(C)N(O)C(C)(C)C1.COCCCOC1CC(C)(C)N(O)C(C)(C)C1.COCCOC1CC(C)(C)N(O)C(C)(C)C1 |
| InChI | InChI=1S/C13H27NO3.C12H25NO3.C11H21NO3.C10H21NO2.4CH4/c1-12(2)9-11(17-8-6-7-16-5)10-13(3,4)14(12)15;1-11(2)8-10(16-7-6-15-5)9-12(3,4)13(11)14;1-8(13)15-9-6-10(2,3)12(14)11(4,5)7-9;1-9(2)6-8(13-5)7-10(3,4)11(9)12;;;;/h11,15H,6-10H2,1-5H3;10,14H,6-9H2,1-5H3;9,14H,6-7H2,1-5H3;8,12H,6-7H2,1-5H3;4*1H4 |
| InChIKey | GRSVUVQOYLWJLO-UHFFFAOYSA-N |
| XLogP | 11.06 |
| TPSA | 166.33 Ų |
| H-Bond Donors | 4 |
| H-Bond Acceptors | 15 |
| Rotatable Bonds | 11 |
| Heavy Atoms | 65 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 943.45 |
| LogP ≤ 5 | 11.06 |
| H-Bond Donors ≤ 5 | 4 |
| H-Bond Acceptors ≤ 10 | 15 |
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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