N-phenyl-4-phenyldiazenylaniline

C18H15N3 — CID 7575

IUPACN-phenyl-4-phenyldiazenylaniline
SMILESc1ccc(/N=N/c2ccc(Nc3ccccc3)cc2)cc1
InChIInChI=1S/C18H15N3/c1-3-7-15(8-4-1)19-16-11-13-18(14-12-16)21-20-17-9-5-2-6-10-17/h1-14,19H/b21-20+
InChIKeyVXLFYNFOITWQPM-QZQOTICOSA-N
MW273.34 g/mol
LogP5.85
Rot. Bonds4

About N-phenyl-4-phenyldiazenylaniline

N-phenyl-4-phenyldiazenylaniline (PubChem CID 7575) has the molecular formula C18H15N3 and a molecular weight of 273.34 g/mol. Its IUPAC name is N-phenyl-4-phenyldiazenylaniline.

Molecular Properties

Compound NameN-phenyl-4-phenyldiazenylaniline
PubChem CID7575
Molecular FormulaC18H15N3
Molecular Weight273.34 g/mol
Exact Mass273.13
IUPAC NameN-phenyl-4-phenyldiazenylaniline
SMILESc1ccc(/N=N/c2ccc(Nc3ccccc3)cc2)cc1
InChIInChI=1S/C18H15N3/c1-3-7-15(8-4-1)19-16-11-13-18(14-12-16)21-20-17-9-5-2-6-10-17/h1-14,19H/b21-20+
InChIKeyVXLFYNFOITWQPM-QZQOTICOSA-N
XLogP5.85
TPSA36.75 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500273.34
LogP ≤ 55.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-phenyl-4-phenyldiazenylaniline?
The IUPAC name of N-phenyl-4-phenyldiazenylaniline (CID 7575) is N-phenyl-4-phenyldiazenylaniline.
What is the SMILES notation for N-phenyl-4-phenyldiazenylaniline?
The canonical SMILES for N-phenyl-4-phenyldiazenylaniline is c1ccc(/N=N/c2ccc(Nc3ccccc3)cc2)cc1.
What is the InChIKey of N-phenyl-4-phenyldiazenylaniline?
The InChIKey is VXLFYNFOITWQPM-QZQOTICOSA-N. The full InChI is InChI=1S/C18H15N3/c1-3-7-15(8-4-1)19-16-11-13-18(14-12-16)21-20-17-9-5-2-6-10-17/h1-14,19H/b21-20+.
What are the key properties of N-phenyl-4-phenyldiazenylaniline?
N-phenyl-4-phenyldiazenylaniline has a molecular weight of 273.34 g/mol, XLogP of 5.85, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-4-phenyldiazenylaniline is sourced from PubChem (CID 7575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).