About 3-[2-[tert-butyl(dimethyl)silyl]oxyethylamino]propan-1-ol
3-[2-[tert-butyl(dimethyl)silyl]oxyethylamino]propan-1-ol (PubChem CID 156692863) has the molecular formula C11H27NO2Si
and a molecular weight of 233.43 g/mol. Its IUPAC name is 3-[2-[tert-butyl(dimethyl)silyl]oxyethylamino]propan-1-ol.
Molecular Properties
| Compound Name | 3-[2-[tert-butyl(dimethyl)silyl]oxyethylamino]propan-1-ol |
| PubChem CID | 156692863 |
| Molecular Formula | C11H27NO2Si |
| Molecular Weight | 233.43 g/mol |
| Exact Mass | 233.18 |
| IUPAC Name | 3-[2-[tert-butyl(dimethyl)silyl]oxyethylamino]propan-1-ol |
| SMILES | CC(C)(C)[Si](C)(C)OCCNCCCO |
| InChI | InChI=1S/C11H27NO2Si/c1-11(2,3)15(4,5)14-10-8-12-7-6-9-13/h12-13H,6-10H2,1-5H3 |
| InChIKey | MQFWWVLWFBKSRF-UHFFFAOYSA-N |
| XLogP | 1.98 |
| TPSA | 41.49 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 233.43 |
| LogP ≤ 5 | 1.98 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 3-[2-[tert-butyl(dimethyl)silyl]oxyethylamino]propan-1-ol?
The IUPAC name of 3-[2-[tert-butyl(dimethyl)silyl]oxyethylamino]propan-1-ol (CID 156692863) is 3-[2-[tert-butyl(dimethyl)silyl]oxyethylamino]propan-1-ol.
What is the SMILES notation for 3-[2-[tert-butyl(dimethyl)silyl]oxyethylamino]propan-1-ol?
The canonical SMILES for 3-[2-[tert-butyl(dimethyl)silyl]oxyethylamino]propan-1-ol is CC(C)(C)[Si](C)(C)OCCNCCCO.
What is the InChIKey of 3-[2-[tert-butyl(dimethyl)silyl]oxyethylamino]propan-1-ol?
The InChIKey is MQFWWVLWFBKSRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H27NO2Si/c1-11(2,3)15(4,5)14-10-8-12-7-6-9-13/h12-13H,6-10H2,1-5H3.
What are the key properties of 3-[2-[tert-butyl(dimethyl)silyl]oxyethylamino]propan-1-ol?
3-[2-[tert-butyl(dimethyl)silyl]oxyethylamino]propan-1-ol has a molecular weight of 233.43 g/mol, XLogP of 1.98, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[tert-butyl(dimethyl)silyl]oxyethylamino]propan-1-ol is sourced from PubChem (CID 156692863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).