About N-decyl-2-[diethyl(prop-1-enyl)silyl]ethanimine
N-decyl-2-[diethyl(prop-1-enyl)silyl]ethanimine (PubChem CID 123304085) has the molecular formula C19H39NSi
and a molecular weight of 309.61 g/mol. Its IUPAC name is N-decyl-2-[diethyl(prop-1-enyl)silyl]ethanimine.
Molecular Properties
| Compound Name | N-decyl-2-[diethyl(prop-1-enyl)silyl]ethanimine |
| PubChem CID | 123304085 |
| Molecular Formula | C19H39NSi |
| Molecular Weight | 309.61 g/mol |
| Exact Mass | 309.29 |
| IUPAC Name | N-decyl-2-[diethyl(prop-1-enyl)silyl]ethanimine |
| SMILES | CC=C[Si](CC)(CC)C/C=N/CCCCCCCCCC |
| InChI | InChI=1S/C19H39NSi/c1-5-9-10-11-12-13-14-15-16-20-17-19-21(7-3,8-4)18-6-2/h6,17-18H,5,7-16,19H2,1-4H3/b18-6?,20-17+ |
| InChIKey | XMNLPIZEOSFXHO-XUJDVTRVSA-N |
| XLogP | 6.80 |
| TPSA | 12.36 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 14 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 309.61 |
| LogP ≤ 5 | 6.80 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-decyl-2-[diethyl(prop-1-enyl)silyl]ethanimine?
The IUPAC name of N-decyl-2-[diethyl(prop-1-enyl)silyl]ethanimine (CID 123304085) is N-decyl-2-[diethyl(prop-1-enyl)silyl]ethanimine.
What is the SMILES notation for N-decyl-2-[diethyl(prop-1-enyl)silyl]ethanimine?
The canonical SMILES for N-decyl-2-[diethyl(prop-1-enyl)silyl]ethanimine is CC=C[Si](CC)(CC)C/C=N/CCCCCCCCCC.
What is the InChIKey of N-decyl-2-[diethyl(prop-1-enyl)silyl]ethanimine?
The InChIKey is XMNLPIZEOSFXHO-XUJDVTRVSA-N. The full InChI is InChI=1S/C19H39NSi/c1-5-9-10-11-12-13-14-15-16-20-17-19-21(7-3,8-4)18-6-2/h6,17-18H,5,7-16,19H2,1-4H3/b18-6?,20-17+.
What are the key properties of N-decyl-2-[diethyl(prop-1-enyl)silyl]ethanimine?
N-decyl-2-[diethyl(prop-1-enyl)silyl]ethanimine has a molecular weight of 309.61 g/mol, XLogP of 6.80, 14 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-decyl-2-[diethyl(prop-1-enyl)silyl]ethanimine is sourced from PubChem (CID 123304085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).