About prop-1-enyl-dipropyl-(2-pyrrolidin-1-ylethyl)silane
prop-1-enyl-dipropyl-(2-pyrrolidin-1-ylethyl)silane (PubChem CID 67432810) has the molecular formula C15H31NSi
and a molecular weight of 253.51 g/mol. Its IUPAC name is prop-1-enyl-dipropyl-(2-pyrrolidin-1-ylethyl)silane.
Molecular Properties
| Compound Name | prop-1-enyl-dipropyl-(2-pyrrolidin-1-ylethyl)silane |
| PubChem CID | 67432810 |
| Molecular Formula | C15H31NSi |
| Molecular Weight | 253.51 g/mol |
| Exact Mass | 253.22 |
| IUPAC Name | prop-1-enyl-dipropyl-(2-pyrrolidin-1-ylethyl)silane |
| SMILES | CC=C[Si](CCC)(CCC)CCN1CCCC1 |
| InChI | InChI=1S/C15H31NSi/c1-4-12-17(13-5-2,14-6-3)15-11-16-9-7-8-10-16/h4,12H,5-11,13-15H2,1-3H3 |
| InChIKey | PHRIURDQLFMYSS-UHFFFAOYSA-N |
| XLogP | 4.47 |
| TPSA | 3.24 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 253.51 |
| LogP ≤ 5 | 4.47 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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 prop-1-enyl-dipropyl-(2-pyrrolidin-1-ylethyl)silane?
The IUPAC name of prop-1-enyl-dipropyl-(2-pyrrolidin-1-ylethyl)silane (CID 67432810) is prop-1-enyl-dipropyl-(2-pyrrolidin-1-ylethyl)silane.
What is the SMILES notation for prop-1-enyl-dipropyl-(2-pyrrolidin-1-ylethyl)silane?
The canonical SMILES for prop-1-enyl-dipropyl-(2-pyrrolidin-1-ylethyl)silane is CC=C[Si](CCC)(CCC)CCN1CCCC1.
What is the InChIKey of prop-1-enyl-dipropyl-(2-pyrrolidin-1-ylethyl)silane?
The InChIKey is PHRIURDQLFMYSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NSi/c1-4-12-17(13-5-2,14-6-3)15-11-16-9-7-8-10-16/h4,12H,5-11,13-15H2,1-3H3.
What are the key properties of prop-1-enyl-dipropyl-(2-pyrrolidin-1-ylethyl)silane?
prop-1-enyl-dipropyl-(2-pyrrolidin-1-ylethyl)silane has a molecular weight of 253.51 g/mol, XLogP of 4.47, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for prop-1-enyl-dipropyl-(2-pyrrolidin-1-ylethyl)silane is sourced from PubChem (CID 67432810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).