About 2-[(2-methylphenyl)methylideneamino]phenol
2-[(2-methylphenyl)methylideneamino]phenol (PubChem CID 11009223) has the molecular formula C14H13NO
and a molecular weight of 211.26 g/mol. Its IUPAC name is 2-[(2-methylphenyl)methylideneamino]phenol.
Molecular Properties
| Compound Name | 2-[(2-methylphenyl)methylideneamino]phenol |
| PubChem CID | 11009223 |
| Molecular Formula | C14H13NO |
| Molecular Weight | 211.26 g/mol |
| Exact Mass | 211.10 |
| IUPAC Name | 2-[(2-methylphenyl)methylideneamino]phenol |
| SMILES | Cc1ccccc1/C=N/c1ccccc1O |
| InChI | InChI=1S/C14H13NO/c1-11-6-2-3-7-12(11)10-15-13-8-4-5-9-14(13)16/h2-10,16H,1H3/b15-10+ |
| InChIKey | YMTUGBLNOISCTD-XNTDXEJSSA-N |
| XLogP | 3.45 |
| TPSA | 32.59 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 211.26 |
| LogP ≤ 5 | 3.45 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_phenol_A(3)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-[(2-methylphenyl)methylideneamino]phenol?
The IUPAC name of 2-[(2-methylphenyl)methylideneamino]phenol (CID 11009223) is 2-[(2-methylphenyl)methylideneamino]phenol.
What is the SMILES notation for 2-[(2-methylphenyl)methylideneamino]phenol?
The canonical SMILES for 2-[(2-methylphenyl)methylideneamino]phenol is Cc1ccccc1/C=N/c1ccccc1O.
What is the InChIKey of 2-[(2-methylphenyl)methylideneamino]phenol?
The InChIKey is YMTUGBLNOISCTD-XNTDXEJSSA-N. The full InChI is InChI=1S/C14H13NO/c1-11-6-2-3-7-12(11)10-15-13-8-4-5-9-14(13)16/h2-10,16H,1H3/b15-10+.
What are the key properties of 2-[(2-methylphenyl)methylideneamino]phenol?
2-[(2-methylphenyl)methylideneamino]phenol has a molecular weight of 211.26 g/mol, XLogP of 3.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylphenyl)methylideneamino]phenol is sourced from PubChem (CID 11009223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).