1-phenyl-N-(4-phenyldiazenylphenyl)methanimine

C19H15N3 — CID 601900

IUPAC1-phenyl-N-(4-phenyldiazenylphenyl)methanimine
SMILESC(=N/c1ccc(/N=N/c2ccccc2)cc1)\c1ccccc1
InChIInChI=1S/C19H15N3/c1-3-7-16(8-4-1)15-20-17-11-13-19(14-12-17)22-21-18-9-5-2-6-10-18/h1-15H/b20-15+,22-21+
InChIKeyVRVLFCXOZDZYCV-FLVZMUOLSA-N
MW285.35 g/mol
LogP5.85
Rot. Bonds4

About 1-phenyl-N-(4-phenyldiazenylphenyl)methanimine

1-phenyl-N-(4-phenyldiazenylphenyl)methanimine (PubChem CID 601900) has the molecular formula C19H15N3 and a molecular weight of 285.35 g/mol. Its IUPAC name is 1-phenyl-N-(4-phenyldiazenylphenyl)methanimine.

Molecular Properties

Compound Name1-phenyl-N-(4-phenyldiazenylphenyl)methanimine
PubChem CID601900
Molecular FormulaC19H15N3
Molecular Weight285.35 g/mol
Exact Mass285.13
IUPAC Name1-phenyl-N-(4-phenyldiazenylphenyl)methanimine
SMILESC(=N/c1ccc(/N=N/c2ccccc2)cc1)\c1ccccc1
InChIInChI=1S/C19H15N3/c1-3-7-16(8-4-1)15-20-17-11-13-19(14-12-17)22-21-18-9-5-2-6-10-18/h1-15H/b20-15+,22-21+
InChIKeyVRVLFCXOZDZYCV-FLVZMUOLSA-N
XLogP5.85
TPSA37.08 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500285.35
LogP ≤ 55.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-(4-phenyldiazenylphenyl)methanimine?
The IUPAC name of 1-phenyl-N-(4-phenyldiazenylphenyl)methanimine (CID 601900) is 1-phenyl-N-(4-phenyldiazenylphenyl)methanimine.
What is the SMILES notation for 1-phenyl-N-(4-phenyldiazenylphenyl)methanimine?
The canonical SMILES for 1-phenyl-N-(4-phenyldiazenylphenyl)methanimine is C(=N/c1ccc(/N=N/c2ccccc2)cc1)\c1ccccc1.
What is the InChIKey of 1-phenyl-N-(4-phenyldiazenylphenyl)methanimine?
The InChIKey is VRVLFCXOZDZYCV-FLVZMUOLSA-N. The full InChI is InChI=1S/C19H15N3/c1-3-7-16(8-4-1)15-20-17-11-13-19(14-12-17)22-21-18-9-5-2-6-10-18/h1-15H/b20-15+,22-21+.
What are the key properties of 1-phenyl-N-(4-phenyldiazenylphenyl)methanimine?
1-phenyl-N-(4-phenyldiazenylphenyl)methanimine has a molecular weight of 285.35 g/mol, XLogP of 5.85, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-(4-phenyldiazenylphenyl)methanimine is sourced from PubChem (CID 601900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).