About 8-[dihydroxy(propyl)silyl]octan-1-amine
8-[dihydroxy(propyl)silyl]octan-1-amine (PubChem CID 87682842) has the molecular formula C11H27NO2Si
and a molecular weight of 233.43 g/mol. Its IUPAC name is 8-[dihydroxy(propyl)silyl]octan-1-amine.
Molecular Properties
| Compound Name | 8-[dihydroxy(propyl)silyl]octan-1-amine |
| PubChem CID | 87682842 |
| Molecular Formula | C11H27NO2Si |
| Molecular Weight | 233.43 g/mol |
| Exact Mass | 233.18 |
| IUPAC Name | 8-[dihydroxy(propyl)silyl]octan-1-amine |
| SMILES | CCC[Si](O)(O)CCCCCCCCN |
| InChI | InChI=1S/C11H27NO2Si/c1-2-10-15(13,14)11-8-6-4-3-5-7-9-12/h13-14H,2-12H2,1H3 |
| InChIKey | QOUUATIJNRSHMW-UHFFFAOYSA-N |
| XLogP | 2.12 |
| TPSA | 66.48 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 233.43 |
| LogP ≤ 5 | 2.12 |
| H-Bond Donors ≤ 5 | 3 |
| 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 8-[dihydroxy(propyl)silyl]octan-1-amine?
The IUPAC name of 8-[dihydroxy(propyl)silyl]octan-1-amine (CID 87682842) is 8-[dihydroxy(propyl)silyl]octan-1-amine.
What is the SMILES notation for 8-[dihydroxy(propyl)silyl]octan-1-amine?
The canonical SMILES for 8-[dihydroxy(propyl)silyl]octan-1-amine is CCC[Si](O)(O)CCCCCCCCN.
What is the InChIKey of 8-[dihydroxy(propyl)silyl]octan-1-amine?
The InChIKey is QOUUATIJNRSHMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H27NO2Si/c1-2-10-15(13,14)11-8-6-4-3-5-7-9-12/h13-14H,2-12H2,1H3.
What are the key properties of 8-[dihydroxy(propyl)silyl]octan-1-amine?
8-[dihydroxy(propyl)silyl]octan-1-amine has a molecular weight of 233.43 g/mol, XLogP of 2.12, 10 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[dihydroxy(propyl)silyl]octan-1-amine is sourced from PubChem (CID 87682842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).