2-(pyridin-2-yldiazenyl)naphthalen-1-ol

C15H11N3O — CID 2831996

IUPAC2-(pyridin-2-yldiazenyl)naphthalen-1-ol
SMILESOc1c(/N=N/c2ccccn2)ccc2ccccc12
InChIInChI=1S/C15H11N3O/c19-15-12-6-2-1-5-11(12)8-9-13(15)17-18-14-7-3-4-10-16-14/h1-10,19H/b18-17+
InChIKeyDKWJRBBUVAQOAC-ISLYRVAYSA-N
MW249.27 g/mol
LogP4.36
Rot. Bonds2

About 2-(pyridin-2-yldiazenyl)naphthalen-1-ol

2-(pyridin-2-yldiazenyl)naphthalen-1-ol (PubChem CID 2831996) has the molecular formula C15H11N3O and a molecular weight of 249.27 g/mol. Its IUPAC name is 2-(pyridin-2-yldiazenyl)naphthalen-1-ol.

Molecular Properties

Compound Name2-(pyridin-2-yldiazenyl)naphthalen-1-ol
PubChem CID2831996
Molecular FormulaC15H11N3O
Molecular Weight249.27 g/mol
Exact Mass249.09
IUPAC Name2-(pyridin-2-yldiazenyl)naphthalen-1-ol
SMILESOc1c(/N=N/c2ccccn2)ccc2ccccc12
InChIInChI=1S/C15H11N3O/c19-15-12-6-2-1-5-11(12)8-9-13(15)17-18-14-7-3-4-10-16-14/h1-10,19H/b18-17+
InChIKeyDKWJRBBUVAQOAC-ISLYRVAYSA-N
XLogP4.36
TPSA57.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.27
LogP ≤ 54.36
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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Frequently Asked Questions

What is the IUPAC name of 2-(pyridin-2-yldiazenyl)naphthalen-1-ol?
The IUPAC name of 2-(pyridin-2-yldiazenyl)naphthalen-1-ol (CID 2831996) is 2-(pyridin-2-yldiazenyl)naphthalen-1-ol.
What is the SMILES notation for 2-(pyridin-2-yldiazenyl)naphthalen-1-ol?
The canonical SMILES for 2-(pyridin-2-yldiazenyl)naphthalen-1-ol is Oc1c(/N=N/c2ccccn2)ccc2ccccc12.
What is the InChIKey of 2-(pyridin-2-yldiazenyl)naphthalen-1-ol?
The InChIKey is DKWJRBBUVAQOAC-ISLYRVAYSA-N. The full InChI is InChI=1S/C15H11N3O/c19-15-12-6-2-1-5-11(12)8-9-13(15)17-18-14-7-3-4-10-16-14/h1-10,19H/b18-17+.
What are the key properties of 2-(pyridin-2-yldiazenyl)naphthalen-1-ol?
2-(pyridin-2-yldiazenyl)naphthalen-1-ol has a molecular weight of 249.27 g/mol, XLogP of 4.36, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(pyridin-2-yldiazenyl)naphthalen-1-ol is sourced from PubChem (CID 2831996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).