About 1-(2-ethylphenyl)-N-phenylmethanimine
1-(2-ethylphenyl)-N-phenylmethanimine (PubChem CID 23340918) has the molecular formula C15H15N
and a molecular weight of 209.29 g/mol. Its IUPAC name is 1-(2-ethylphenyl)-N-phenylmethanimine.
Molecular Properties
| Compound Name | 1-(2-ethylphenyl)-N-phenylmethanimine |
| PubChem CID | 23340918 |
| Molecular Formula | C15H15N |
| Molecular Weight | 209.29 g/mol |
| Exact Mass | 209.12 |
| IUPAC Name | 1-(2-ethylphenyl)-N-phenylmethanimine |
| SMILES | CCc1ccccc1/C=N/c1ccccc1 |
| InChI | InChI=1S/C15H15N/c1-2-13-8-6-7-9-14(13)12-16-15-10-4-3-5-11-15/h3-12H,2H2,1H3/b16-12+ |
| InChIKey | UYFMOBYECXNPIM-FOWTUZBSSA-N |
| XLogP | 4.00 |
| TPSA | 12.36 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 209.29 |
| LogP ≤ 5 | 4.00 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_1', 'substructure': 'N/A'} |
|---|
Analyze 1-(2-ethylphenyl)-N-phenylmethanimine with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of 1-(2-ethylphenyl)-N-phenylmethanimine?
The IUPAC name of 1-(2-ethylphenyl)-N-phenylmethanimine (CID 23340918) is 1-(2-ethylphenyl)-N-phenylmethanimine.
What is the SMILES notation for 1-(2-ethylphenyl)-N-phenylmethanimine?
The canonical SMILES for 1-(2-ethylphenyl)-N-phenylmethanimine is CCc1ccccc1/C=N/c1ccccc1.
What is the InChIKey of 1-(2-ethylphenyl)-N-phenylmethanimine?
The InChIKey is UYFMOBYECXNPIM-FOWTUZBSSA-N. The full InChI is InChI=1S/C15H15N/c1-2-13-8-6-7-9-14(13)12-16-15-10-4-3-5-11-15/h3-12H,2H2,1H3/b16-12+.
What are the key properties of 1-(2-ethylphenyl)-N-phenylmethanimine?
1-(2-ethylphenyl)-N-phenylmethanimine has a molecular weight of 209.29 g/mol, XLogP of 4.00, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylphenyl)-N-phenylmethanimine is sourced from PubChem (CID 23340918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).