About N-[(Z)-(2-fluorophenyl)methylideneamino]-N-phenylaniline
N-[(Z)-(2-fluorophenyl)methylideneamino]-N-phenylaniline (PubChem CID 7921961) has the molecular formula C19H15FN2
and a molecular weight of 290.34 g/mol. Its IUPAC name is N-[(Z)-(2-fluorophenyl)methylideneamino]-N-phenylaniline.
Molecular Properties
| Compound Name | N-[(Z)-(2-fluorophenyl)methylideneamino]-N-phenylaniline |
| PubChem CID | 7921961 |
| Molecular Formula | C19H15FN2 |
| Molecular Weight | 290.34 g/mol |
| Exact Mass | 290.12 |
| IUPAC Name | N-[(Z)-(2-fluorophenyl)methylideneamino]-N-phenylaniline |
| SMILES | Fc1ccccc1/C=N\N(c1ccccc1)c1ccccc1 |
| InChI | InChI=1S/C19H15FN2/c20-19-14-8-7-9-16(19)15-21-22(17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-15H/b21-15- |
| InChIKey | CNCCJGUZHLJJMI-QNGOZBTKSA-N |
| XLogP | 5.00 |
| TPSA | 15.60 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 290.34 |
| LogP ≤ 5 | 5.00 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-[(Z)-(2-fluorophenyl)methylideneamino]-N-phenylaniline?
The IUPAC name of N-[(Z)-(2-fluorophenyl)methylideneamino]-N-phenylaniline (CID 7921961) is N-[(Z)-(2-fluorophenyl)methylideneamino]-N-phenylaniline.
What is the SMILES notation for N-[(Z)-(2-fluorophenyl)methylideneamino]-N-phenylaniline?
The canonical SMILES for N-[(Z)-(2-fluorophenyl)methylideneamino]-N-phenylaniline is Fc1ccccc1/C=N\N(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[(Z)-(2-fluorophenyl)methylideneamino]-N-phenylaniline?
The InChIKey is CNCCJGUZHLJJMI-QNGOZBTKSA-N. The full InChI is InChI=1S/C19H15FN2/c20-19-14-8-7-9-16(19)15-21-22(17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-15H/b21-15-.
What are the key properties of N-[(Z)-(2-fluorophenyl)methylideneamino]-N-phenylaniline?
N-[(Z)-(2-fluorophenyl)methylideneamino]-N-phenylaniline has a molecular weight of 290.34 g/mol, XLogP of 5.00, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(2-fluorophenyl)methylideneamino]-N-phenylaniline is sourced from PubChem (CID 7921961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).