About N-[(E)-dec-1-enyl]benzamide
N-[(E)-dec-1-enyl]benzamide (PubChem CID 71501503) has the molecular formula C17H25NO
and a molecular weight of 259.39 g/mol. Its IUPAC name is N-[(E)-dec-1-enyl]benzamide.
Molecular Properties
| Compound Name | N-[(E)-dec-1-enyl]benzamide |
| PubChem CID | 71501503 |
| Molecular Formula | C17H25NO |
| Molecular Weight | 259.39 g/mol |
| Exact Mass | 259.19 |
| IUPAC Name | N-[(E)-dec-1-enyl]benzamide |
| SMILES | CCCCCCCC/C=C/NC(=O)c1ccccc1 |
| InChI | InChI=1S/C17H25NO/c1-2-3-4-5-6-7-8-12-15-18-17(19)16-13-10-9-11-14-16/h9-15H,2-8H2,1H3,(H,18,19)/b15-12+ |
| InChIKey | HSOSTPJFWZTYMY-NTCAYCPXSA-N |
| XLogP | 4.68 |
| TPSA | 29.10 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 9 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 259.39 |
| LogP ≤ 5 | 4.68 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-[(E)-dec-1-enyl]benzamide?
The IUPAC name of N-[(E)-dec-1-enyl]benzamide (CID 71501503) is N-[(E)-dec-1-enyl]benzamide.
What is the SMILES notation for N-[(E)-dec-1-enyl]benzamide?
The canonical SMILES for N-[(E)-dec-1-enyl]benzamide is CCCCCCCC/C=C/NC(=O)c1ccccc1.
What is the InChIKey of N-[(E)-dec-1-enyl]benzamide?
The InChIKey is HSOSTPJFWZTYMY-NTCAYCPXSA-N. The full InChI is InChI=1S/C17H25NO/c1-2-3-4-5-6-7-8-12-15-18-17(19)16-13-10-9-11-14-16/h9-15H,2-8H2,1H3,(H,18,19)/b15-12+.
What are the key properties of N-[(E)-dec-1-enyl]benzamide?
N-[(E)-dec-1-enyl]benzamide has a molecular weight of 259.39 g/mol, XLogP of 4.68, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-dec-1-enyl]benzamide is sourced from PubChem (CID 71501503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).