2,4-Dimethylaniline
Representations & DB's id
| ||
| ChEBI: | CHEBI:27840 | |
|---|---|---|
| ChEMBL: | CHEMBL1490826 | |
| PubChem: | 7250 | |
| IUPAC: | 2,4-dimethylaniline | |
| Standard InChI: | InChI=1S/C8H11N/c1-6-3-4-8(9)7(2)5-6/h3-5H,9H2,1-2H3 | |
| Standard InChI Key: | CZZZABOKJQXEBO-UHFFFAOYSA-N | |
| SMILES: | Cc1ccc(c(c1)C)N | |
Molecular propeties
| ||
| AlogP: | 1.89 | |
|---|---|---|
| Hydrogen bonds acceptors: | 1 | |
| Hydrogen bonds donors: | 1 | |
| Rotatable bonds: | 0 | |
| Number of rings: | 1 | |
| Molecular Weight: | 121.09 | |
| Topological polar surface area: | 26 | |
| Number of aromatic rings: | 1 | |
| Fsp3: | 0.25 | |
| Number of carbons: | 8 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
|---|