(1-methylnaphthalen-2-yl)-(4-methylphenyl)diazene

C18H16N2 — CID 20764516

IUPAC(1-methylnaphthalen-2-yl)-(4-methylphenyl)diazene
SMILESCc1ccc(/N=N/c2ccc3ccccc3c2C)cc1
InChIInChI=1S/C18H16N2/c1-13-7-10-16(11-8-13)19-20-18-12-9-15-5-3-4-6-17(15)14(18)2/h3-12H,1-2H3/b20-19+
InChIKeySSQYSXQYNBPCJJ-FMQUCBEESA-N
MW260.34 g/mol
LogP5.87
Rot. Bonds2

About (1-methylnaphthalen-2-yl)-(4-methylphenyl)diazene

(1-methylnaphthalen-2-yl)-(4-methylphenyl)diazene (PubChem CID 20764516) has the molecular formula C18H16N2 and a molecular weight of 260.34 g/mol. Its IUPAC name is (1-methylnaphthalen-2-yl)-(4-methylphenyl)diazene.

Molecular Properties

Compound Name(1-methylnaphthalen-2-yl)-(4-methylphenyl)diazene
PubChem CID20764516
Molecular FormulaC18H16N2
Molecular Weight260.34 g/mol
Exact Mass260.13
IUPAC Name(1-methylnaphthalen-2-yl)-(4-methylphenyl)diazene
SMILESCc1ccc(/N=N/c2ccc3ccccc3c2C)cc1
InChIInChI=1S/C18H16N2/c1-13-7-10-16(11-8-13)19-20-18-12-9-15-5-3-4-6-17(15)14(18)2/h3-12H,1-2H3/b20-19+
InChIKeySSQYSXQYNBPCJJ-FMQUCBEESA-N
XLogP5.87
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500260.34
LogP ≤ 55.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 (1-methylnaphthalen-2-yl)-(4-methylphenyl)diazene?
The IUPAC name of (1-methylnaphthalen-2-yl)-(4-methylphenyl)diazene (CID 20764516) is (1-methylnaphthalen-2-yl)-(4-methylphenyl)diazene.
What is the SMILES notation for (1-methylnaphthalen-2-yl)-(4-methylphenyl)diazene?
The canonical SMILES for (1-methylnaphthalen-2-yl)-(4-methylphenyl)diazene is Cc1ccc(/N=N/c2ccc3ccccc3c2C)cc1.
What is the InChIKey of (1-methylnaphthalen-2-yl)-(4-methylphenyl)diazene?
The InChIKey is SSQYSXQYNBPCJJ-FMQUCBEESA-N. The full InChI is InChI=1S/C18H16N2/c1-13-7-10-16(11-8-13)19-20-18-12-9-15-5-3-4-6-17(15)14(18)2/h3-12H,1-2H3/b20-19+.
What are the key properties of (1-methylnaphthalen-2-yl)-(4-methylphenyl)diazene?
(1-methylnaphthalen-2-yl)-(4-methylphenyl)diazene has a molecular weight of 260.34 g/mol, XLogP of 5.87, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylnaphthalen-2-yl)-(4-methylphenyl)diazene is sourced from PubChem (CID 20764516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).