About trimethylsilyl N-[3-[dimethyl(propoxy)silyl]propyl]-N-phenylcarbamate
trimethylsilyl N-[3-[dimethyl(propoxy)silyl]propyl]-N-phenylcarbamate (PubChem CID 140591284) has the molecular formula C18H33NO3Si2
and a molecular weight of 367.64 g/mol. Its IUPAC name is trimethylsilyl N-[3-[dimethyl(propoxy)silyl]propyl]-N-phenylcarbamate.
Molecular Properties
| Compound Name | trimethylsilyl N-[3-[dimethyl(propoxy)silyl]propyl]-N-phenylcarbamate |
| PubChem CID | 140591284 |
| Molecular Formula | C18H33NO3Si2 |
| Molecular Weight | 367.64 g/mol |
| Exact Mass | 367.20 |
| IUPAC Name | trimethylsilyl N-[3-[dimethyl(propoxy)silyl]propyl]-N-phenylcarbamate |
| SMILES | CCCO[Si](C)(C)CCCN(C(=O)O[Si](C)(C)C)c1ccccc1 |
| InChI | InChI=1S/C18H33NO3Si2/c1-7-15-21-24(5,6)16-11-14-19(17-12-9-8-10-13-17)18(20)22-23(2,3)4/h8-10,12-13H,7,11,14-16H2,1-6H3 |
| InChIKey | CUGLXQWYBHLVGS-UHFFFAOYSA-N |
| XLogP | 5.49 |
| TPSA | 38.77 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Heavy Atoms | 24 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 367.64 |
| LogP ≤ 5 | 5.49 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of trimethylsilyl N-[3-[dimethyl(propoxy)silyl]propyl]-N-phenylcarbamate?
The IUPAC name of trimethylsilyl N-[3-[dimethyl(propoxy)silyl]propyl]-N-phenylcarbamate (CID 140591284) is trimethylsilyl N-[3-[dimethyl(propoxy)silyl]propyl]-N-phenylcarbamate.
What is the SMILES notation for trimethylsilyl N-[3-[dimethyl(propoxy)silyl]propyl]-N-phenylcarbamate?
The canonical SMILES for trimethylsilyl N-[3-[dimethyl(propoxy)silyl]propyl]-N-phenylcarbamate is CCCO[Si](C)(C)CCCN(C(=O)O[Si](C)(C)C)c1ccccc1.
What is the InChIKey of trimethylsilyl N-[3-[dimethyl(propoxy)silyl]propyl]-N-phenylcarbamate?
The InChIKey is CUGLXQWYBHLVGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H33NO3Si2/c1-7-15-21-24(5,6)16-11-14-19(17-12-9-8-10-13-17)18(20)22-23(2,3)4/h8-10,12-13H,7,11,14-16H2,1-6H3.
What are the key properties of trimethylsilyl N-[3-[dimethyl(propoxy)silyl]propyl]-N-phenylcarbamate?
trimethylsilyl N-[3-[dimethyl(propoxy)silyl]propyl]-N-phenylcarbamate has a molecular weight of 367.64 g/mol, XLogP of 5.49, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl N-[3-[dimethyl(propoxy)silyl]propyl]-N-phenylcarbamate is sourced from PubChem (CID 140591284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).