About N-(1-diethoxysilylpentyl)benzamide
N-(1-diethoxysilylpentyl)benzamide (PubChem CID 173241563) has the molecular formula C16H27NO3Si
and a molecular weight of 309.48 g/mol. Its IUPAC name is N-(1-diethoxysilylpentyl)benzamide.
Molecular Properties
| Compound Name | N-(1-diethoxysilylpentyl)benzamide |
| PubChem CID | 173241563 |
| Molecular Formula | C16H27NO3Si |
| Molecular Weight | 309.48 g/mol |
| Exact Mass | 309.18 |
| IUPAC Name | N-(1-diethoxysilylpentyl)benzamide |
| SMILES | CCCCC(NC(=O)c1ccccc1)[SiH](OCC)OCC |
| InChI | InChI=1S/C16H27NO3Si/c1-4-7-13-15(21(19-5-2)20-6-3)17-16(18)14-11-9-8-10-12-14/h8-12,15,21H,4-7,13H2,1-3H3,(H,17,18) |
| InChIKey | UEWBINRUWJMCMD-UHFFFAOYSA-N |
| XLogP | 2.81 |
| TPSA | 47.56 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 309.48 |
| LogP ≤ 5 | 2.81 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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 N-(1-diethoxysilylpentyl)benzamide?
The IUPAC name of N-(1-diethoxysilylpentyl)benzamide (CID 173241563) is N-(1-diethoxysilylpentyl)benzamide.
What is the SMILES notation for N-(1-diethoxysilylpentyl)benzamide?
The canonical SMILES for N-(1-diethoxysilylpentyl)benzamide is CCCCC(NC(=O)c1ccccc1)[SiH](OCC)OCC.
What is the InChIKey of N-(1-diethoxysilylpentyl)benzamide?
The InChIKey is UEWBINRUWJMCMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO3Si/c1-4-7-13-15(21(19-5-2)20-6-3)17-16(18)14-11-9-8-10-12-14/h8-12,15,21H,4-7,13H2,1-3H3,(H,17,18).
What are the key properties of N-(1-diethoxysilylpentyl)benzamide?
N-(1-diethoxysilylpentyl)benzamide has a molecular weight of 309.48 g/mol, XLogP of 2.81, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-diethoxysilylpentyl)benzamide is sourced from PubChem (CID 173241563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).