(2-ethoxyphenyl)-pyridin-2-yldiazene

C13H13N3O — CID 122538186

IUPAC(2-ethoxyphenyl)-pyridin-2-yldiazene
SMILESCCOc1ccccc1/N=N/c1ccccn1
InChIInChI=1S/C13H13N3O/c1-2-17-12-8-4-3-7-11(12)15-16-13-9-5-6-10-14-13/h3-10H,2H2,1H3/b16-15+
InChIKeyVGOULNGICYSLMT-FOCLMDBBSA-N
MW227.27 g/mol
LogP3.90
Rot. Bonds4

About (2-ethoxyphenyl)-pyridin-2-yldiazene

(2-ethoxyphenyl)-pyridin-2-yldiazene (PubChem CID 122538186) has the molecular formula C13H13N3O and a molecular weight of 227.27 g/mol. Its IUPAC name is (2-ethoxyphenyl)-pyridin-2-yldiazene.

Molecular Properties

Compound Name(2-ethoxyphenyl)-pyridin-2-yldiazene
PubChem CID122538186
Molecular FormulaC13H13N3O
Molecular Weight227.27 g/mol
Exact Mass227.11
IUPAC Name(2-ethoxyphenyl)-pyridin-2-yldiazene
SMILESCCOc1ccccc1/N=N/c1ccccn1
InChIInChI=1S/C13H13N3O/c1-2-17-12-8-4-3-7-11(12)15-16-13-9-5-6-10-14-13/h3-10H,2H2,1H3/b16-15+
InChIKeyVGOULNGICYSLMT-FOCLMDBBSA-N
XLogP3.90
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.27
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (2-ethoxyphenyl)-pyridin-2-yldiazene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2-ethoxyphenyl)-pyridin-2-yldiazene?
The IUPAC name of (2-ethoxyphenyl)-pyridin-2-yldiazene (CID 122538186) is (2-ethoxyphenyl)-pyridin-2-yldiazene.
What is the SMILES notation for (2-ethoxyphenyl)-pyridin-2-yldiazene?
The canonical SMILES for (2-ethoxyphenyl)-pyridin-2-yldiazene is CCOc1ccccc1/N=N/c1ccccn1.
What is the InChIKey of (2-ethoxyphenyl)-pyridin-2-yldiazene?
The InChIKey is VGOULNGICYSLMT-FOCLMDBBSA-N. The full InChI is InChI=1S/C13H13N3O/c1-2-17-12-8-4-3-7-11(12)15-16-13-9-5-6-10-14-13/h3-10H,2H2,1H3/b16-15+.
What are the key properties of (2-ethoxyphenyl)-pyridin-2-yldiazene?
(2-ethoxyphenyl)-pyridin-2-yldiazene has a molecular weight of 227.27 g/mol, XLogP of 3.90, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethoxyphenyl)-pyridin-2-yldiazene is sourced from PubChem (CID 122538186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).