About 4-[methyl(2-phenylethenyl)amino]phenol
4-[methyl(2-phenylethenyl)amino]phenol (PubChem CID 174417234) has the molecular formula C15H15NO
and a molecular weight of 225.29 g/mol. Its IUPAC name is 4-[methyl(2-phenylethenyl)amino]phenol.
Molecular Properties
| Compound Name | 4-[methyl(2-phenylethenyl)amino]phenol |
| PubChem CID | 174417234 |
| Molecular Formula | C15H15NO |
| Molecular Weight | 225.29 g/mol |
| Exact Mass | 225.12 |
| IUPAC Name | 4-[methyl(2-phenylethenyl)amino]phenol |
| SMILES | CN(C=Cc1ccccc1)c1ccc(O)cc1 |
| InChI | InChI=1S/C15H15NO/c1-16(14-7-9-15(17)10-8-14)12-11-13-5-3-2-4-6-13/h2-12,17H,1H3 |
| InChIKey | HOLFKLLOZAOZST-UHFFFAOYSA-N |
| XLogP | 3.50 |
| TPSA | 23.47 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 225.29 |
| LogP ≤ 5 | 3.50 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 4-[methyl(2-phenylethenyl)amino]phenol?
The IUPAC name of 4-[methyl(2-phenylethenyl)amino]phenol (CID 174417234) is 4-[methyl(2-phenylethenyl)amino]phenol.
What is the SMILES notation for 4-[methyl(2-phenylethenyl)amino]phenol?
The canonical SMILES for 4-[methyl(2-phenylethenyl)amino]phenol is CN(C=Cc1ccccc1)c1ccc(O)cc1.
What is the InChIKey of 4-[methyl(2-phenylethenyl)amino]phenol?
The InChIKey is HOLFKLLOZAOZST-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c1-16(14-7-9-15(17)10-8-14)12-11-13-5-3-2-4-6-13/h2-12,17H,1H3.
What are the key properties of 4-[methyl(2-phenylethenyl)amino]phenol?
4-[methyl(2-phenylethenyl)amino]phenol has a molecular weight of 225.29 g/mol, XLogP of 3.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[methyl(2-phenylethenyl)amino]phenol is sourced from PubChem (CID 174417234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).