(3-methoxyphenyl)-naphthalen-2-yldiazene

C17H14N2O — CID 581663

IUPAC(3-methoxyphenyl)-naphthalen-2-yldiazene
SMILESCOc1cccc(/N=N/c2ccc3ccccc3c2)c1
InChIInChI=1S/C17H14N2O/c1-20-17-8-4-7-15(12-17)18-19-16-10-9-13-5-2-3-6-14(13)11-16/h2-12H,1H3/b19-18+
InChIKeyIFIZCXUTMICZLQ-VHEBQXMUSA-N
MW262.31 g/mol
LogP5.26
Rot. Bonds3

About (3-methoxyphenyl)-naphthalen-2-yldiazene

(3-methoxyphenyl)-naphthalen-2-yldiazene (PubChem CID 581663) has the molecular formula C17H14N2O and a molecular weight of 262.31 g/mol. Its IUPAC name is (3-methoxyphenyl)-naphthalen-2-yldiazene.

Molecular Properties

Compound Name(3-methoxyphenyl)-naphthalen-2-yldiazene
PubChem CID581663
Molecular FormulaC17H14N2O
Molecular Weight262.31 g/mol
Exact Mass262.11
IUPAC Name(3-methoxyphenyl)-naphthalen-2-yldiazene
SMILESCOc1cccc(/N=N/c2ccc3ccccc3c2)c1
InChIInChI=1S/C17H14N2O/c1-20-17-8-4-7-15(12-17)18-19-16-10-9-13-5-2-3-6-14(13)11-16/h2-12H,1H3/b19-18+
InChIKeyIFIZCXUTMICZLQ-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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Related Compounds

(4-methoxyphenyl)-naphthalen-2-yldiazene
CID 572318
2-(hydroxymethyl)-4-[(3-methoxyphenyl)diazenyl]phenol
CID 136794349
(3-methoxyphenyl)-[(3-methoxyphenyl)methyl]diazene
CID 157276293
1,3-dimethoxybenzene;1,4-dimethoxybenzene
CID 91359455
naphthalen-2-yl-[6-[2-[6-(naphthalen-2-yldiazenyl)naphthalen-2-yl]ethenyl]naphthalen-2-yl]diazene
CID 72565674
anisole;ethane;2-methoxynaphthalene;propane
CID 158674412
sodium N-(3-methoxyphenyl)iminosulfamate
CID 23715155
2-(1H-benzimidazol-2-yl)-4-[(3-methoxyphenyl)diazenyl]phenol
CID 136742412
4,5-dimethoxy-2-(naphthalen-2-yldiazenyl)benzoic acid
CID 581598
anisole;N,N'-diphenylmethanediimine
CID 157139667
naphthalen-2-yl-[4-[(E)-prop-1-enyl]phenyl]diazene
CID 58979901
1-(3-methoxyphenyl)-2-naphthalen-2-ylethane-1,2-dione
CID 170457473

Frequently Asked Questions

What is the IUPAC name of (3-methoxyphenyl)-naphthalen-2-yldiazene?
The IUPAC name of (3-methoxyphenyl)-naphthalen-2-yldiazene (CID 581663) is (3-methoxyphenyl)-naphthalen-2-yldiazene.
What is the SMILES notation for (3-methoxyphenyl)-naphthalen-2-yldiazene?
The canonical SMILES for (3-methoxyphenyl)-naphthalen-2-yldiazene is COc1cccc(/N=N/c2ccc3ccccc3c2)c1.
What is the InChIKey of (3-methoxyphenyl)-naphthalen-2-yldiazene?
The InChIKey is IFIZCXUTMICZLQ-VHEBQXMUSA-N. The full InChI is InChI=1S/C17H14N2O/c1-20-17-8-4-7-15(12-17)18-19-16-10-9-13-5-2-3-6-14(13)11-16/h2-12H,1H3/b19-18+.
What are the key properties of (3-methoxyphenyl)-naphthalen-2-yldiazene?
(3-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 (3-methoxyphenyl)-naphthalen-2-yldiazene is sourced from PubChem (CID 581663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).