About N-[[diethynyl(methyl)silyl]-ethynyl-methylsilyl]-N-ethylethanamine
N-[[diethynyl(methyl)silyl]-ethynyl-methylsilyl]-N-ethylethanamine (PubChem CID 86230382) has the molecular formula C12H19NSi2
and a molecular weight of 233.46 g/mol. Its IUPAC name is N-[[diethynyl(methyl)silyl]-ethynyl-methylsilyl]-N-ethylethanamine.
Molecular Properties
| Compound Name | N-[[diethynyl(methyl)silyl]-ethynyl-methylsilyl]-N-ethylethanamine |
| PubChem CID | 86230382 |
| Molecular Formula | C12H19NSi2 |
| Molecular Weight | 233.46 g/mol |
| Exact Mass | 233.11 |
| IUPAC Name | N-[[diethynyl(methyl)silyl]-ethynyl-methylsilyl]-N-ethylethanamine |
| SMILES | C#C[Si](C)(C#C)[Si](C)(C#C)N(CC)CC |
| InChI | InChI=1S/C12H19NSi2/c1-8-13(9-2)15(7,12-5)14(6,10-3)11-4/h3-5H,8-9H2,1-2,6-7H3 |
| InChIKey | PYHTZKSPRMLBFP-UHFFFAOYSA-N |
| XLogP | 1.58 |
| TPSA | 3.24 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 233.46 |
| LogP ≤ 5 | 1.58 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-[[diethynyl(methyl)silyl]-ethynyl-methylsilyl]-N-ethylethanamine?
The IUPAC name of N-[[diethynyl(methyl)silyl]-ethynyl-methylsilyl]-N-ethylethanamine (CID 86230382) is N-[[diethynyl(methyl)silyl]-ethynyl-methylsilyl]-N-ethylethanamine.
What is the SMILES notation for N-[[diethynyl(methyl)silyl]-ethynyl-methylsilyl]-N-ethylethanamine?
The canonical SMILES for N-[[diethynyl(methyl)silyl]-ethynyl-methylsilyl]-N-ethylethanamine is C#C[Si](C)(C#C)[Si](C)(C#C)N(CC)CC.
What is the InChIKey of N-[[diethynyl(methyl)silyl]-ethynyl-methylsilyl]-N-ethylethanamine?
The InChIKey is PYHTZKSPRMLBFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NSi2/c1-8-13(9-2)15(7,12-5)14(6,10-3)11-4/h3-5H,8-9H2,1-2,6-7H3.
What are the key properties of N-[[diethynyl(methyl)silyl]-ethynyl-methylsilyl]-N-ethylethanamine?
N-[[diethynyl(methyl)silyl]-ethynyl-methylsilyl]-N-ethylethanamine has a molecular weight of 233.46 g/mol, XLogP of 1.58, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[diethynyl(methyl)silyl]-ethynyl-methylsilyl]-N-ethylethanamine is sourced from PubChem (CID 86230382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).