About N'-cyclohexyl-N-ethylethane-1,2-diimine
N'-cyclohexyl-N-ethylethane-1,2-diimine (PubChem CID 58291568) has the molecular formula C10H18N2
and a molecular weight of 166.27 g/mol. Its IUPAC name is N'-cyclohexyl-N-ethylethane-1,2-diimine.
Molecular Properties
| Compound Name | N'-cyclohexyl-N-ethylethane-1,2-diimine |
| PubChem CID | 58291568 |
| Molecular Formula | C10H18N2 |
| Molecular Weight | 166.27 g/mol |
| Exact Mass | 166.15 |
| IUPAC Name | N'-cyclohexyl-N-ethylethane-1,2-diimine |
| SMILES | CC/N=C/C=N/C1CCCCC1 |
| InChI | InChI=1S/C10H18N2/c1-2-11-8-9-12-10-6-4-3-5-7-10/h8-10H,2-7H2,1H3/b11-8+,12-9+ |
| InChIKey | MQUOTLZSNWFCKK-HZOWPXDZSA-N |
| XLogP | 2.48 |
| TPSA | 24.72 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 166.27 |
| LogP ≤ 5 | 2.48 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_1', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N'-cyclohexyl-N-ethylethane-1,2-diimine?
The IUPAC name of N'-cyclohexyl-N-ethylethane-1,2-diimine (CID 58291568) is N'-cyclohexyl-N-ethylethane-1,2-diimine.
What is the SMILES notation for N'-cyclohexyl-N-ethylethane-1,2-diimine?
The canonical SMILES for N'-cyclohexyl-N-ethylethane-1,2-diimine is CC/N=C/C=N/C1CCCCC1.
What is the InChIKey of N'-cyclohexyl-N-ethylethane-1,2-diimine?
The InChIKey is MQUOTLZSNWFCKK-HZOWPXDZSA-N. The full InChI is InChI=1S/C10H18N2/c1-2-11-8-9-12-10-6-4-3-5-7-10/h8-10H,2-7H2,1H3/b11-8+,12-9+.
What are the key properties of N'-cyclohexyl-N-ethylethane-1,2-diimine?
N'-cyclohexyl-N-ethylethane-1,2-diimine has a molecular weight of 166.27 g/mol, XLogP of 2.48, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclohexyl-N-ethylethane-1,2-diimine is sourced from PubChem (CID 58291568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).