About N-trimethylsilyloxybut-1-en-1-amine
N-trimethylsilyloxybut-1-en-1-amine (PubChem CID 90844551) has the molecular formula C7H17NOSi
and a molecular weight of 159.30 g/mol. Its IUPAC name is N-trimethylsilyloxybut-1-en-1-amine.
Molecular Properties
| Compound Name | N-trimethylsilyloxybut-1-en-1-amine |
| PubChem CID | 90844551 |
| Molecular Formula | C7H17NOSi |
| Molecular Weight | 159.30 g/mol |
| Exact Mass | 159.11 |
| IUPAC Name | N-trimethylsilyloxybut-1-en-1-amine |
| SMILES | CCC=CNO[Si](C)(C)C |
| InChI | InChI=1S/C7H17NOSi/c1-5-6-7-8-9-10(2,3)4/h6-8H,5H2,1-4H3 |
| InChIKey | HUSHVFJZBFSNRV-UHFFFAOYSA-N |
| XLogP | 2.27 |
| TPSA | 21.26 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 10 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 159.30 |
| LogP ≤ 5 | 2.27 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-trimethylsilyloxybut-1-en-1-amine?
The IUPAC name of N-trimethylsilyloxybut-1-en-1-amine (CID 90844551) is N-trimethylsilyloxybut-1-en-1-amine.
What is the SMILES notation for N-trimethylsilyloxybut-1-en-1-amine?
The canonical SMILES for N-trimethylsilyloxybut-1-en-1-amine is CCC=CNO[Si](C)(C)C.
What is the InChIKey of N-trimethylsilyloxybut-1-en-1-amine?
The InChIKey is HUSHVFJZBFSNRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NOSi/c1-5-6-7-8-9-10(2,3)4/h6-8H,5H2,1-4H3.
What are the key properties of N-trimethylsilyloxybut-1-en-1-amine?
N-trimethylsilyloxybut-1-en-1-amine has a molecular weight of 159.30 g/mol, XLogP of 2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-trimethylsilyloxybut-1-en-1-amine is sourced from PubChem (CID 90844551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).