(4-methoxyphenyl)-naphthalen-2-yldiazene

C17H14N2O — CID 572318

IUPAC(4-methoxyphenyl)-naphthalen-2-yldiazene
SMILESCOc1ccc(/N=N/c2ccc3ccccc3c2)cc1
InChIInChI=1S/C17H14N2O/c1-20-17-10-8-15(9-11-17)18-19-16-7-6-13-4-2-3-5-14(13)12-16/h2-12H,1H3/b19-18+
InChIKeyIRXVOXVFERKGHR-VHEBQXMUSA-N
MW262.31 g/mol
LogP5.26
Rot. Bonds3

About (4-methoxyphenyl)-naphthalen-2-yldiazene

(4-methoxyphenyl)-naphthalen-2-yldiazene (PubChem CID 572318) has the molecular formula C17H14N2O and a molecular weight of 262.31 g/mol. Its IUPAC name is (4-methoxyphenyl)-naphthalen-2-yldiazene.

Molecular Properties

Compound Name(4-methoxyphenyl)-naphthalen-2-yldiazene
PubChem CID572318
Molecular FormulaC17H14N2O
Molecular Weight262.31 g/mol
Exact Mass262.11
IUPAC Name(4-methoxyphenyl)-naphthalen-2-yldiazene
SMILESCOc1ccc(/N=N/c2ccc3ccccc3c2)cc1
InChIInChI=1S/C17H14N2O/c1-20-17-10-8-15(9-11-17)18-19-16-7-6-13-4-2-3-5-14(13)12-16/h2-12H,1H3/b19-18+
InChIKeyIRXVOXVFERKGHR-VHEBQXMUSA-N
XLogP5.26
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500262.31
LogP ≤ 55.26
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'}

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Frequently Asked Questions

What is the IUPAC name of (4-methoxyphenyl)-naphthalen-2-yldiazene?
The IUPAC name of (4-methoxyphenyl)-naphthalen-2-yldiazene (CID 572318) is (4-methoxyphenyl)-naphthalen-2-yldiazene.
What is the SMILES notation for (4-methoxyphenyl)-naphthalen-2-yldiazene?
The canonical SMILES for (4-methoxyphenyl)-naphthalen-2-yldiazene is COc1ccc(/N=N/c2ccc3ccccc3c2)cc1.
What is the InChIKey of (4-methoxyphenyl)-naphthalen-2-yldiazene?
The InChIKey is IRXVOXVFERKGHR-VHEBQXMUSA-N. The full InChI is InChI=1S/C17H14N2O/c1-20-17-10-8-15(9-11-17)18-19-16-7-6-13-4-2-3-5-14(13)12-16/h2-12H,1H3/b19-18+.
What are the key properties of (4-methoxyphenyl)-naphthalen-2-yldiazene?
(4-methoxyphenyl)-naphthalen-2-yldiazene has a molecular weight of 262.31 g/mol, XLogP of 5.26, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxyphenyl)-naphthalen-2-yldiazene is sourced from PubChem (CID 572318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).