About (Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine
(Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine (PubChem CID 142977776) has the molecular formula C11H15NO2
and a molecular weight of 193.25 g/mol. Its IUPAC name is (Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine.
Molecular Properties
| Compound Name | (Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine |
| PubChem CID | 142977776 |
| Molecular Formula | C11H15NO2 |
| Molecular Weight | 193.25 g/mol |
| Exact Mass | 193.11 |
| IUPAC Name | (Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine |
| SMILES | CCO/N=C(/C)c1ccc(OC)cc1 |
| InChI | InChI=1S/C11H15NO2/c1-4-14-12-9(2)10-5-7-11(13-3)8-6-10/h5-8H,4H2,1-3H3/b12-9- |
| InChIKey | ASWFCXFYZJVCGC-XFXZXTDPSA-N |
| XLogP | 2.46 |
| TPSA | 30.82 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 193.25 |
| LogP ≤ 5 | 2.46 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of (Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine?
The IUPAC name of (Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine (CID 142977776) is (Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine.
What is the SMILES notation for (Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine?
The canonical SMILES for (Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine is CCO/N=C(/C)c1ccc(OC)cc1.
What is the InChIKey of (Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine?
The InChIKey is ASWFCXFYZJVCGC-XFXZXTDPSA-N. The full InChI is InChI=1S/C11H15NO2/c1-4-14-12-9(2)10-5-7-11(13-3)8-6-10/h5-8H,4H2,1-3H3/b12-9-.
What are the key properties of (Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine?
(Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine has a molecular weight of 193.25 g/mol, XLogP of 2.46, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine is sourced from PubChem (CID 142977776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).