About trimethyl-(2-methyl-2-phenyl-3-propan-2-ylideneaziridin-1-yl)silane
trimethyl-(2-methyl-2-phenyl-3-propan-2-ylideneaziridin-1-yl)silane (PubChem CID 13448793) has the molecular formula C15H23NSi
and a molecular weight of 245.44 g/mol. Its IUPAC name is trimethyl-(2-methyl-2-phenyl-3-propan-2-ylideneaziridin-1-yl)silane.
Molecular Properties
| Compound Name | trimethyl-(2-methyl-2-phenyl-3-propan-2-ylideneaziridin-1-yl)silane |
| PubChem CID | 13448793 |
| Molecular Formula | C15H23NSi |
| Molecular Weight | 245.44 g/mol |
| Exact Mass | 245.16 |
| IUPAC Name | trimethyl-(2-methyl-2-phenyl-3-propan-2-ylideneaziridin-1-yl)silane |
| SMILES | CC(C)=C1N([Si](C)(C)C)C1(C)c1ccccc1 |
| InChI | InChI=1S/C15H23NSi/c1-12(2)14-15(3,16(14)17(4,5)6)13-10-8-7-9-11-13/h7-11H,1-6H3 |
| InChIKey | OUYMJUAKCVBAGI-UHFFFAOYSA-N |
| XLogP | 4.35 |
| TPSA | 3.01 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 245.44 |
| LogP ≤ 5 | 4.35 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of trimethyl-(2-methyl-2-phenyl-3-propan-2-ylideneaziridin-1-yl)silane?
The IUPAC name of trimethyl-(2-methyl-2-phenyl-3-propan-2-ylideneaziridin-1-yl)silane (CID 13448793) is trimethyl-(2-methyl-2-phenyl-3-propan-2-ylideneaziridin-1-yl)silane.
What is the SMILES notation for trimethyl-(2-methyl-2-phenyl-3-propan-2-ylideneaziridin-1-yl)silane?
The canonical SMILES for trimethyl-(2-methyl-2-phenyl-3-propan-2-ylideneaziridin-1-yl)silane is CC(C)=C1N([Si](C)(C)C)C1(C)c1ccccc1.
What is the InChIKey of trimethyl-(2-methyl-2-phenyl-3-propan-2-ylideneaziridin-1-yl)silane?
The InChIKey is OUYMJUAKCVBAGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NSi/c1-12(2)14-15(3,16(14)17(4,5)6)13-10-8-7-9-11-13/h7-11H,1-6H3.
What are the key properties of trimethyl-(2-methyl-2-phenyl-3-propan-2-ylideneaziridin-1-yl)silane?
trimethyl-(2-methyl-2-phenyl-3-propan-2-ylideneaziridin-1-yl)silane has a molecular weight of 245.44 g/mol, XLogP of 4.35, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(2-methyl-2-phenyl-3-propan-2-ylideneaziridin-1-yl)silane is sourced from PubChem (CID 13448793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).