About (3S)-1-methylsilylpyrrolidin-3-ol
(3S)-1-methylsilylpyrrolidin-3-ol (PubChem CID 123545340) has the molecular formula C5H13NOSi
and a molecular weight of 131.25 g/mol. Its IUPAC name is (3S)-1-methylsilylpyrrolidin-3-ol.
Molecular Properties
| Compound Name | (3S)-1-methylsilylpyrrolidin-3-ol |
| PubChem CID | 123545340 |
| Molecular Formula | C5H13NOSi |
| Molecular Weight | 131.25 g/mol |
| Exact Mass | 131.08 |
| IUPAC Name | (3S)-1-methylsilylpyrrolidin-3-ol |
| SMILES | C[SiH2]N1CC[C@H](O)C1 |
| InChI | InChI=1S/C5H13NOSi/c1-8-6-3-2-5(7)4-6/h5,7H,2-4,8H2,1H3/t5-/m0/s1 |
| InChIKey | RVCDKXOEDZIKRF-YFKPBYRVSA-N |
| XLogP | -0.82 |
| TPSA | 23.47 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 8 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 131.25 |
| LogP ≤ 5 | -0.82 |
| H-Bond Donors ≤ 5 | 1 |
| 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 (3S)-1-methylsilylpyrrolidin-3-ol?
The IUPAC name of (3S)-1-methylsilylpyrrolidin-3-ol (CID 123545340) is (3S)-1-methylsilylpyrrolidin-3-ol.
What is the SMILES notation for (3S)-1-methylsilylpyrrolidin-3-ol?
The canonical SMILES for (3S)-1-methylsilylpyrrolidin-3-ol is C[SiH2]N1CC[C@H](O)C1.
What is the InChIKey of (3S)-1-methylsilylpyrrolidin-3-ol?
The InChIKey is RVCDKXOEDZIKRF-YFKPBYRVSA-N. The full InChI is InChI=1S/C5H13NOSi/c1-8-6-3-2-5(7)4-6/h5,7H,2-4,8H2,1H3/t5-/m0/s1.
What are the key properties of (3S)-1-methylsilylpyrrolidin-3-ol?
(3S)-1-methylsilylpyrrolidin-3-ol has a molecular weight of 131.25 g/mol, XLogP of -0.82, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-1-methylsilylpyrrolidin-3-ol is sourced from PubChem (CID 123545340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).