About CID 58092066
CID 58092066 (PubChem CID 58092066) has the molecular formula C20H25O2Si
and a molecular weight of 325.50 g/mol.
Molecular Properties
| Compound Name | CID 58092066 |
|---|
| PubChem CID | 58092066 |
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| Molecular Formula | C20H25O2Si |
|---|
| Molecular Weight | 325.50 g/mol |
|---|
| Exact Mass | 325.16 |
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| IUPAC Name | — |
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| SMILES | C[Si](COC1CCC2C=CC=CC21)OC1CCc2ccccc21 |
|---|
| InChI | InChI=1S/C20H25O2Si/c1-23(22-20-13-11-16-7-3-5-9-18(16)20)14-21-19-12-10-15-6-2-4-8-17(15)19/h2-9,15,17,19-20H,10-14H2,1H3 |
|---|
| InChIKey | FPVBSEVTFRBSOD-UHFFFAOYSA-N |
|---|
| XLogP | 4.39 |
|---|
| TPSA | 18.46 Ų |
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| H-Bond Donors | |
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| H-Bond Acceptors | 2 |
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| Rotatable Bonds | 5 |
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| Heavy Atoms | 23 |
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| Complexity | — |
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Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|
| MW ≤ 500 | 325.50 |
| LogP ≤ 5 | 4.39 |
| 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 CID 58092066?
The IUPAC name of CID 58092066 (CID 58092066) is not available.
What is the SMILES notation for CID 58092066?
The canonical SMILES for CID 58092066 is C[Si](COC1CCC2C=CC=CC21)OC1CCc2ccccc21.
What is the InChIKey of CID 58092066?
The InChIKey is FPVBSEVTFRBSOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25O2Si/c1-23(22-20-13-11-16-7-3-5-9-18(16)20)14-21-19-12-10-15-6-2-4-8-17(15)19/h2-9,15,17,19-20H,10-14H2,1H3.
What are the key properties of CID 58092066?
CID 58092066 has a molecular weight of 325.50 g/mol, XLogP of 4.39, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58092066 is sourced from PubChem (CID 58092066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).