2-[(4-ethoxyphenyl)diazenyl]naphthalen-1-ol

C18H16N2O2 — CID 3019160

IUPAC2-[(4-ethoxyphenyl)diazenyl]naphthalen-1-ol
SMILESCCOc1ccc(/N=N/c2ccc3ccccc3c2O)cc1
InChIInChI=1S/C18H16N2O2/c1-2-22-15-10-8-14(9-11-15)19-20-17-12-7-13-5-3-4-6-16(13)18(17)21/h3-12,21H,2H2,1H3/b20-19+
InChIKeyVAZSTSILCJFPMW-FMQUCBEESA-N
MW292.34 g/mol
LogP5.36
Rot. Bonds4

About 2-[(4-ethoxyphenyl)diazenyl]naphthalen-1-ol

2-[(4-ethoxyphenyl)diazenyl]naphthalen-1-ol (PubChem CID 3019160) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is 2-[(4-ethoxyphenyl)diazenyl]naphthalen-1-ol.

Molecular Properties

Compound Name2-[(4-ethoxyphenyl)diazenyl]naphthalen-1-ol
PubChem CID3019160
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Name2-[(4-ethoxyphenyl)diazenyl]naphthalen-1-ol
SMILESCCOc1ccc(/N=N/c2ccc3ccccc3c2O)cc1
InChIInChI=1S/C18H16N2O2/c1-2-22-15-10-8-14(9-11-15)19-20-17-12-7-13-5-3-4-6-16(13)18(17)21/h3-12,21H,2H2,1H3/b20-19+
InChIKeyVAZSTSILCJFPMW-FMQUCBEESA-N
XLogP5.36
TPSA54.18 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500292.34
LogP ≤ 55.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

2-[(4-bromophenyl)diazenyl]naphthalen-1-ol
CID 3802677
2-[(2-hydroxyphenyl)diazenyl]naphthalen-1-ol
CID 135744709
2-[(4-methoxyphenyl)diazenyl]naphthalene-1,5-diol
CID 137230625
(1-bromonaphthalen-2-yl)-(4-methoxyphenyl)diazene
CID 572351
[4-[11-[1-(2-octadecoxynaphthalen-1-yl)naphthalen-2-yl]oxyundecoxy]phenyl]-[1-[2-[[4-[11-[1-(2-octadecoxynaphthalen-1-yl)naphthalen-2-yl]oxyundecoxy]phenyl]diazenyl]naphthalen-1-yl]naphthalen-2-yl]diazene
CID 102112802
2-[(3-chloro-2-hydroxyphenyl)diazenyl]naphthalen-1-ol
CID 135740067
ethane;2-(propan-2-yldiazenyl)naphthalen-1-ol
CID 136657153
5-ethoxy-2-[(4-phenyldiazenylphenyl)diazenyl]benzenesulfonic acid
CID 3019151
ethane;N-(4-ethoxyphenyl)-1-hydroxynaphthalene-2-carboxamide
CID 143289888
N-(4-ethoxyphenyl)-3-hydroxy-4-phenyldiazenylnaphthalene-2-carboxamide
CID 155007361
2-[(methyldiazenyl)methyldiazenyl]naphthalen-1-ol
CID 136968902
2-bromo-4-tert-butyl-6-[(4-ethoxyphenyl)diazenyl]phenol
CID 3360060

Frequently Asked Questions

What is the IUPAC name of 2-[(4-ethoxyphenyl)diazenyl]naphthalen-1-ol?
The IUPAC name of 2-[(4-ethoxyphenyl)diazenyl]naphthalen-1-ol (CID 3019160) is 2-[(4-ethoxyphenyl)diazenyl]naphthalen-1-ol.
What is the SMILES notation for 2-[(4-ethoxyphenyl)diazenyl]naphthalen-1-ol?
The canonical SMILES for 2-[(4-ethoxyphenyl)diazenyl]naphthalen-1-ol is CCOc1ccc(/N=N/c2ccc3ccccc3c2O)cc1.
What is the InChIKey of 2-[(4-ethoxyphenyl)diazenyl]naphthalen-1-ol?
The InChIKey is VAZSTSILCJFPMW-FMQUCBEESA-N. The full InChI is InChI=1S/C18H16N2O2/c1-2-22-15-10-8-14(9-11-15)19-20-17-12-7-13-5-3-4-6-16(13)18(17)21/h3-12,21H,2H2,1H3/b20-19+.
What are the key properties of 2-[(4-ethoxyphenyl)diazenyl]naphthalen-1-ol?
2-[(4-ethoxyphenyl)diazenyl]naphthalen-1-ol has a molecular weight of 292.34 g/mol, XLogP of 5.36, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethoxyphenyl)diazenyl]naphthalen-1-ol is sourced from PubChem (CID 3019160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).