About (E)-N-cyclohexyloct-4-enamide
(E)-N-cyclohexyloct-4-enamide (PubChem CID 166446536) has the molecular formula C14H25NO
and a molecular weight of 223.36 g/mol. Its IUPAC name is (E)-N-cyclohexyloct-4-enamide.
Molecular Properties
| Compound Name | (E)-N-cyclohexyloct-4-enamide |
| PubChem CID | 166446536 |
| Molecular Formula | C14H25NO |
| Molecular Weight | 223.36 g/mol |
| Exact Mass | 223.19 |
| IUPAC Name | (E)-N-cyclohexyloct-4-enamide |
| SMILES | CCC/C=C/CCC(=O)NC1CCCCC1 |
| InChI | InChI=1S/C14H25NO/c1-2-3-4-5-9-12-14(16)15-13-10-7-6-8-11-13/h4-5,13H,2-3,6-12H2,1H3,(H,15,16)/b5-4+ |
| InChIKey | VEVXHYUMRWPCHK-SNAWJCMRSA-N |
| XLogP | 3.57 |
| TPSA | 29.10 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 223.36 |
| LogP ≤ 5 | 3.57 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of (E)-N-cyclohexyloct-4-enamide?
The IUPAC name of (E)-N-cyclohexyloct-4-enamide (CID 166446536) is (E)-N-cyclohexyloct-4-enamide.
What is the SMILES notation for (E)-N-cyclohexyloct-4-enamide?
The canonical SMILES for (E)-N-cyclohexyloct-4-enamide is CCC/C=C/CCC(=O)NC1CCCCC1.
What is the InChIKey of (E)-N-cyclohexyloct-4-enamide?
The InChIKey is VEVXHYUMRWPCHK-SNAWJCMRSA-N. The full InChI is InChI=1S/C14H25NO/c1-2-3-4-5-9-12-14(16)15-13-10-7-6-8-11-13/h4-5,13H,2-3,6-12H2,1H3,(H,15,16)/b5-4+.
What are the key properties of (E)-N-cyclohexyloct-4-enamide?
(E)-N-cyclohexyloct-4-enamide has a molecular weight of 223.36 g/mol, XLogP of 3.57, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-cyclohexyloct-4-enamide is sourced from PubChem (CID 166446536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).