About methyl N-(2-trimethylsilylethyl)carbamate
methyl N-(2-trimethylsilylethyl)carbamate (PubChem CID 130010810) has the molecular formula C7H17NO2Si
and a molecular weight of 175.30 g/mol. Its IUPAC name is methyl N-(2-trimethylsilylethyl)carbamate.
Molecular Properties
| Compound Name | methyl N-(2-trimethylsilylethyl)carbamate |
| PubChem CID | 130010810 |
| Molecular Formula | C7H17NO2Si |
| Molecular Weight | 175.30 g/mol |
| Exact Mass | 175.10 |
| IUPAC Name | methyl N-(2-trimethylsilylethyl)carbamate |
| SMILES | COC(=O)NCC[Si](C)(C)C |
| InChI | InChI=1S/C7H17NO2Si/c1-10-7(9)8-5-6-11(2,3)4/h5-6H2,1-4H3,(H,8,9) |
| InChIKey | MJHUUIXRQZMDQE-UHFFFAOYSA-N |
| XLogP | 1.68 |
| TPSA | 38.33 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 175.30 |
| LogP ≤ 5 | 1.68 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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 methyl N-(2-trimethylsilylethyl)carbamate?
The IUPAC name of methyl N-(2-trimethylsilylethyl)carbamate (CID 130010810) is methyl N-(2-trimethylsilylethyl)carbamate.
What is the SMILES notation for methyl N-(2-trimethylsilylethyl)carbamate?
The canonical SMILES for methyl N-(2-trimethylsilylethyl)carbamate is COC(=O)NCC[Si](C)(C)C.
What is the InChIKey of methyl N-(2-trimethylsilylethyl)carbamate?
The InChIKey is MJHUUIXRQZMDQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NO2Si/c1-10-7(9)8-5-6-11(2,3)4/h5-6H2,1-4H3,(H,8,9).
What are the key properties of methyl N-(2-trimethylsilylethyl)carbamate?
methyl N-(2-trimethylsilylethyl)carbamate has a molecular weight of 175.30 g/mol, XLogP of 1.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-(2-trimethylsilylethyl)carbamate is sourced from PubChem (CID 130010810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).