About [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-phenylsilane
[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-phenylsilane (PubChem CID 138967373) has the molecular formula C15H25NOSi
and a molecular weight of 263.46 g/mol. Its IUPAC name is [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-phenylsilane.
Molecular Properties
| Compound Name | [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-phenylsilane |
| PubChem CID | 138967373 |
| Molecular Formula | C15H25NOSi |
| Molecular Weight | 263.46 g/mol |
| Exact Mass | 263.17 |
| IUPAC Name | [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-phenylsilane |
| SMILES | COC[C@@H]1CCCN1C[Si](C)(C)c1ccccc1 |
| InChI | InChI=1S/C15H25NOSi/c1-17-12-14-8-7-11-16(14)13-18(2,3)15-9-5-4-6-10-15/h4-6,9-10,14H,7-8,11-13H2,1-3H3/t14-/m0/s1 |
| InChIKey | NIDWLGWDIAGFHH-AWEZNQCLSA-N |
| XLogP | 2.25 |
| TPSA | 12.47 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 263.46 |
| LogP ≤ 5 | 2.25 |
| H-Bond Donors ≤ 5 | 0 |
| 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 [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-phenylsilane?
The IUPAC name of [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-phenylsilane (CID 138967373) is [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-phenylsilane.
What is the SMILES notation for [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-phenylsilane?
The canonical SMILES for [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-phenylsilane is COC[C@@H]1CCCN1C[Si](C)(C)c1ccccc1.
What is the InChIKey of [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-phenylsilane?
The InChIKey is NIDWLGWDIAGFHH-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H25NOSi/c1-17-12-14-8-7-11-16(14)13-18(2,3)15-9-5-4-6-10-15/h4-6,9-10,14H,7-8,11-13H2,1-3H3/t14-/m0/s1.
What are the key properties of [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-phenylsilane?
[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-phenylsilane has a molecular weight of 263.46 g/mol, XLogP of 2.25, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-2-(methoxymethyl)pyrrolidin-1-yl]methyl-dimethyl-phenylsilane is sourced from PubChem (CID 138967373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).