4-[[4-[(4-phenylphenyl)diazenyl]naphthalen-1-yl]diazenyl]naphthalen-1-amine

C32H23N5 — CID 88875063

IUPAC4-[[4-[(4-phenylphenyl)diazenyl]naphthalen-1-yl]diazenyl]naphthalen-1-amine
SMILESNc1ccc(/N=N/c2ccc(/N=N/c3ccc(-c4ccccc4)cc3)c3ccccc23)c2ccccc12
InChIInChI=1S/C32H23N5/c33-29-18-19-30(26-11-5-4-10-25(26)29)36-37-32-21-20-31(27-12-6-7-13-28(27)32)35-34-24-16-14-23(15-17-24)22-8-2-1-3-9-22/h1-21H,33H2/b35-34+,37-36+
InChIKeyUAYIROSJJKWVSW-XGMUGIETSA-N
MW477.57 g/mol
LogP10.07
Rot. Bonds5

About 4-[[4-[(4-phenylphenyl)diazenyl]naphthalen-1-yl]diazenyl]naphthalen-1-amine

4-[[4-[(4-phenylphenyl)diazenyl]naphthalen-1-yl]diazenyl]naphthalen-1-amine (PubChem CID 88875063) has the molecular formula C32H23N5 and a molecular weight of 477.57 g/mol. Its IUPAC name is 4-[[4-[(4-phenylphenyl)diazenyl]naphthalen-1-yl]diazenyl]naphthalen-1-amine.

Molecular Properties

Compound Name4-[[4-[(4-phenylphenyl)diazenyl]naphthalen-1-yl]diazenyl]naphthalen-1-amine
PubChem CID88875063
Molecular FormulaC32H23N5
Molecular Weight477.57 g/mol
Exact Mass477.20
IUPAC Name4-[[4-[(4-phenylphenyl)diazenyl]naphthalen-1-yl]diazenyl]naphthalen-1-amine
SMILESNc1ccc(/N=N/c2ccc(/N=N/c3ccc(-c4ccccc4)cc3)c3ccccc23)c2ccccc12
InChIInChI=1S/C32H23N5/c33-29-18-19-30(26-11-5-4-10-25(26)29)36-37-32-21-20-31(27-12-6-7-13-28(27)32)35-34-24-16-14-23(15-17-24)22-8-2-1-3-9-22/h1-21H,33H2/b35-34+,37-36+
InChIKeyUAYIROSJJKWVSW-XGMUGIETSA-N
XLogP10.07
TPSA75.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500477.57
LogP ≤ 510.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[[4-[(4-phenylphenyl)diazenyl]naphthalen-1-yl]diazenyl]naphthalen-1-amine?
The IUPAC name of 4-[[4-[(4-phenylphenyl)diazenyl]naphthalen-1-yl]diazenyl]naphthalen-1-amine (CID 88875063) is 4-[[4-[(4-phenylphenyl)diazenyl]naphthalen-1-yl]diazenyl]naphthalen-1-amine.
What is the SMILES notation for 4-[[4-[(4-phenylphenyl)diazenyl]naphthalen-1-yl]diazenyl]naphthalen-1-amine?
The canonical SMILES for 4-[[4-[(4-phenylphenyl)diazenyl]naphthalen-1-yl]diazenyl]naphthalen-1-amine is Nc1ccc(/N=N/c2ccc(/N=N/c3ccc(-c4ccccc4)cc3)c3ccccc23)c2ccccc12.
What is the InChIKey of 4-[[4-[(4-phenylphenyl)diazenyl]naphthalen-1-yl]diazenyl]naphthalen-1-amine?
The InChIKey is UAYIROSJJKWVSW-XGMUGIETSA-N. The full InChI is InChI=1S/C32H23N5/c33-29-18-19-30(26-11-5-4-10-25(26)29)36-37-32-21-20-31(27-12-6-7-13-28(27)32)35-34-24-16-14-23(15-17-24)22-8-2-1-3-9-22/h1-21H,33H2/b35-34+,37-36+.
What are the key properties of 4-[[4-[(4-phenylphenyl)diazenyl]naphthalen-1-yl]diazenyl]naphthalen-1-amine?
4-[[4-[(4-phenylphenyl)diazenyl]naphthalen-1-yl]diazenyl]naphthalen-1-amine has a molecular weight of 477.57 g/mol, XLogP of 10.07, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-[(4-phenylphenyl)diazenyl]naphthalen-1-yl]diazenyl]naphthalen-1-amine is sourced from PubChem (CID 88875063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).