About N-(4-ethenylphenyl)-2-phenylaniline
N-(4-ethenylphenyl)-2-phenylaniline (PubChem CID 142706945) has the molecular formula C20H17N
and a molecular weight of 271.36 g/mol. Its IUPAC name is N-(4-ethenylphenyl)-2-phenylaniline.
Molecular Properties
| Compound Name | N-(4-ethenylphenyl)-2-phenylaniline |
| PubChem CID | 142706945 |
| Molecular Formula | C20H17N |
| Molecular Weight | 271.36 g/mol |
| Exact Mass | 271.14 |
| IUPAC Name | N-(4-ethenylphenyl)-2-phenylaniline |
| SMILES | C=Cc1ccc(Nc2ccccc2-c2ccccc2)cc1 |
| InChI | InChI=1S/C20H17N/c1-2-16-12-14-18(15-13-16)21-20-11-7-6-10-19(20)17-8-4-3-5-9-17/h2-15,21H,1H2 |
| InChIKey | DNPOLRMYRUQMBY-UHFFFAOYSA-N |
| XLogP | 5.74 |
| TPSA | 12.03 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 271.36 |
| LogP ≤ 5 | 5.74 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of N-(4-ethenylphenyl)-2-phenylaniline?
The IUPAC name of N-(4-ethenylphenyl)-2-phenylaniline (CID 142706945) is N-(4-ethenylphenyl)-2-phenylaniline.
What is the SMILES notation for N-(4-ethenylphenyl)-2-phenylaniline?
The canonical SMILES for N-(4-ethenylphenyl)-2-phenylaniline is C=Cc1ccc(Nc2ccccc2-c2ccccc2)cc1.
What is the InChIKey of N-(4-ethenylphenyl)-2-phenylaniline?
The InChIKey is DNPOLRMYRUQMBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N/c1-2-16-12-14-18(15-13-16)21-20-11-7-6-10-19(20)17-8-4-3-5-9-17/h2-15,21H,1H2.
What are the key properties of N-(4-ethenylphenyl)-2-phenylaniline?
N-(4-ethenylphenyl)-2-phenylaniline has a molecular weight of 271.36 g/mol, XLogP of 5.74, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethenylphenyl)-2-phenylaniline is sourced from PubChem (CID 142706945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).