About N-[(Z)-(4-phenylphenyl)methylideneamino]aniline
N-[(Z)-(4-phenylphenyl)methylideneamino]aniline (PubChem CID 5356673) has the molecular formula C19H16N2
and a molecular weight of 272.35 g/mol. Its IUPAC name is N-[(Z)-(4-phenylphenyl)methylideneamino]aniline.
Molecular Properties
| Compound Name | N-[(Z)-(4-phenylphenyl)methylideneamino]aniline |
| PubChem CID | 5356673 |
| Molecular Formula | C19H16N2 |
| Molecular Weight | 272.35 g/mol |
| Exact Mass | 272.13 |
| IUPAC Name | N-[(Z)-(4-phenylphenyl)methylideneamino]aniline |
| SMILES | C(=N\Nc1ccccc1)\c1ccc(-c2ccccc2)cc1 |
| InChI | InChI=1S/C19H16N2/c1-3-7-17(8-4-1)18-13-11-16(12-14-18)15-20-21-19-9-5-2-6-10-19/h1-15,21H/b20-15- |
| InChIKey | PTLXOOUUIUZDLN-HKWRFOASSA-N |
| XLogP | 4.80 |
| TPSA | 24.39 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 272.35 |
| LogP ≤ 5 | 4.80 |
| H-Bond Donors ≤ 5 | 1 |
| 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)-(4-phenylphenyl)methylideneamino]aniline?
The IUPAC name of N-[(Z)-(4-phenylphenyl)methylideneamino]aniline (CID 5356673) is N-[(Z)-(4-phenylphenyl)methylideneamino]aniline.
What is the SMILES notation for N-[(Z)-(4-phenylphenyl)methylideneamino]aniline?
The canonical SMILES for N-[(Z)-(4-phenylphenyl)methylideneamino]aniline is C(=N\Nc1ccccc1)\c1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-[(Z)-(4-phenylphenyl)methylideneamino]aniline?
The InChIKey is PTLXOOUUIUZDLN-HKWRFOASSA-N. The full InChI is InChI=1S/C19H16N2/c1-3-7-17(8-4-1)18-13-11-16(12-14-18)15-20-21-19-9-5-2-6-10-19/h1-15,21H/b20-15-.
What are the key properties of N-[(Z)-(4-phenylphenyl)methylideneamino]aniline?
N-[(Z)-(4-phenylphenyl)methylideneamino]aniline has a molecular weight of 272.35 g/mol, XLogP of 4.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(4-phenylphenyl)methylideneamino]aniline is sourced from PubChem (CID 5356673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).