C195H400N20Si10+10 — CID 158303542
4-(ethylamino)butyl-trimethylazanium;10-(ethylamino)decyl-trimethylazanium;2-(ethylamino)ethyl-trimethylazanium;7-(ethylamino)heptyl-trimethylazanium;6-(ethylamino)hexyl-trimethylazanium;9-(ethylamino)nonyl-trimethylazanium;8-(ethylamino)octyl-trimethylazanium;5-(ethylamino)pentyl-trimethylazanium;3-(ethylamino)propyl-trimethylazanium;11-(ethylamino)undecyl-trimethylazanium;decakis(2-phenylethylsilane) (PubChem CID 158303542) has the molecular formula C195H400N20Si10+10 and a molecular weight of 3306.34 g/mol. Its IUPAC name is 4-(ethylamino)butyl-trimethylazanium;10-(ethylamino)decyl-trimethylazanium;2-(ethylamino)ethyl-trimethylazanium;7-(ethylamino)heptyl-trimethylazanium;6-(ethylamino)hexyl-trimethylazanium;9-(ethylamino)nonyl-trimethylazanium;8-(ethylamino)octyl-trimethylazanium;5-(ethylamino)pentyl-trimethylazanium;3-(ethylamino)propyl-trimethylazanium;11-(ethylamino)undecyl-trimethylazanium;decakis(2-phenylethylsilane).
| Compound Name | 4-(ethylamino)butyl-trimethylazanium;10-(ethylamino)decyl-trimethylazanium;2-(ethylamino)ethyl-trimethylazanium;7-(ethylamino)heptyl-trimethylazanium;6-(ethylamino)hexyl-trimethylazanium;9-(ethylamino)nonyl-trimethylazanium;8-(ethylamino)octyl-trimethylazanium;5-(ethylamino)pentyl-trimethylazanium;3-(ethylamino)propyl-trimethylazanium;11-(ethylamino)undecyl-trimethylazanium;decakis(2-phenylethylsilane) |
|---|---|
| PubChem CID | 158303542 |
| Molecular Formula | C195H400N20Si10+10 |
| Molecular Weight | 3306.34 g/mol |
| Exact Mass | 3302.96 |
| IUPAC Name | 4-(ethylamino)butyl-trimethylazanium;10-(ethylamino)decyl-trimethylazanium;2-(ethylamino)ethyl-trimethylazanium;7-(ethylamino)heptyl-trimethylazanium;6-(ethylamino)hexyl-trimethylazanium;9-(ethylamino)nonyl-trimethylazanium;8-(ethylamino)octyl-trimethylazanium;5-(ethylamino)pentyl-trimethylazanium;3-(ethylamino)propyl-trimethylazanium;11-(ethylamino)undecyl-trimethylazanium;decakis(2-phenylethylsilane) |
| SMILES | CCNCCCCCCCCCCC[N+](C)(C)C.CCNCCCCCCCCCC[N+](C)(C)C.CCNCCCCCCCCC[N+](C)(C)C.CCNCCCCCCCC[N+](C)(C)C.CCNCCCCCCC[N+](C)(C)C.CCNCCCCCC[N+](C)(C)C.CCNCCCCC[N+](C)(C)C.CCNCCCC[N+](C)(C)C.CCNCCC[N+](C)(C)C.CCNCC[N+](C)(C)C.[SiH3]CCc1ccccc1.[SiH3]CCc1ccccc1.[SiH3]CCc1ccccc1.[SiH3]CCc1ccccc1.[SiH3]CCc1ccccc1.[SiH3]CCc1ccccc1.[SiH3]CCc1ccccc1.[SiH3]CCc1ccccc1.[SiH3]CCc1ccccc1.[SiH3]CCc1ccccc1 |
| InChI | InChI=1S/C16H37N2.C15H35N2.C14H33N2.C13H31N2.C12H29N2.C11H27N2.C10H25N2.C9H23N2.C8H21N2.10C8H12Si.C7H19N2/c1-5-17-15-13-11-9-7-6-8-10-12-14-16-18(2,3)4;1-5-16-14-12-10-8-6-7-9-11-13-15-17(2,3)4;1-5-15-13-11-9-7-6-8-10-12-14-16(2,3)4;1-5-14-12-10-8-6-7-9-11-13-15(2,3)4;1-5-13-11-9-7-6-8-10-12-14(2,3)4;1-5-12-10-8-6-7-9-11-13(2,3)4;1-5-11-9-7-6-8-10-12(2,3)4;1-5-10-8-6-7-9-11(2,3)4;1-5-9-7-6-8-10(2,3)4;10*9-7-6-8-4-2-1-3-5-8;1-5-8-6-7-9(2,3)4/h17H,5-16H2,1-4H3;16H,5-15H2,1-4H3;15H,5-14H2,1-4H3;14H,5-13H2,1-4H3;13H,5-12H2,1-4H3;12H,5-11H2,1-4H3;11H,5-10H2,1-4H3;10H,5-9H2,1-4H3;9H,5-8H2,1-4H3;10*1-5H,6-7H2,9H3;8H,5-7H2,1-4H3/q9*+1;;;;;;;;;;;+1 |
| InChIKey | GMUFVSMGLBQDOQ-UHFFFAOYSA-N |
| XLogP | 30.70 |
| TPSA | 120.30 Ų |
| H-Bond Donors | 10 |
| H-Bond Acceptors | 10 |
| Rotatable Bonds | 105 |
| Heavy Atoms | 225 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3306.34 |
| LogP ≤ 5 | 30.70 |
| H-Bond Donors ≤ 5 | 10 |
| H-Bond Acceptors ≤ 10 | 10 |
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'} |
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