About [dimethyl(octadecyl)silyl]methanamine
[dimethyl(octadecyl)silyl]methanamine (PubChem CID 87605582) has the molecular formula C21H47NSi
and a molecular weight of 341.70 g/mol. Its IUPAC name is [dimethyl(octadecyl)silyl]methanamine.
Molecular Properties
| Compound Name | [dimethyl(octadecyl)silyl]methanamine |
| PubChem CID | 87605582 |
| Molecular Formula | C21H47NSi |
| Molecular Weight | 341.70 g/mol |
| Exact Mass | 341.35 |
| IUPAC Name | [dimethyl(octadecyl)silyl]methanamine |
| SMILES | CCCCCCCCCCCCCCCCCC[Si](C)(C)CN |
| InChI | InChI=1S/C21H47NSi/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(2,3)21-22/h4-22H2,1-3H3 |
| InChIKey | AWGOVSHWUMSEBQ-UHFFFAOYSA-N |
| XLogP | 7.45 |
| TPSA | 26.02 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 18 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 341.70 |
| LogP ≤ 5 | 7.45 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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 [dimethyl(octadecyl)silyl]methanamine?
The IUPAC name of [dimethyl(octadecyl)silyl]methanamine (CID 87605582) is [dimethyl(octadecyl)silyl]methanamine.
What is the SMILES notation for [dimethyl(octadecyl)silyl]methanamine?
The canonical SMILES for [dimethyl(octadecyl)silyl]methanamine is CCCCCCCCCCCCCCCCCC[Si](C)(C)CN.
What is the InChIKey of [dimethyl(octadecyl)silyl]methanamine?
The InChIKey is AWGOVSHWUMSEBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H47NSi/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(2,3)21-22/h4-22H2,1-3H3.
What are the key properties of [dimethyl(octadecyl)silyl]methanamine?
[dimethyl(octadecyl)silyl]methanamine has a molecular weight of 341.70 g/mol, XLogP of 7.45, 18 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [dimethyl(octadecyl)silyl]methanamine is sourced from PubChem (CID 87605582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).