1-phenyldiazenylnaphthalen-2-ol

C16H12N2O — CID 13297

IUPAC1-phenyldiazenylnaphthalen-2-ol
SMILESOc1ccc2ccccc2c1/N=N/c1ccccc1
InChIInChI=1S/C16H12N2O/c19-15-11-10-12-6-4-5-9-14(12)16(15)18-17-13-7-2-1-3-8-13/h1-11,19H/b18-17+
InChIKeyMRQIXHXHHPWVIL-ISLYRVAYSA-N
MW248.29 g/mol
LogP4.96
Rot. Bonds2

About 1-phenyldiazenylnaphthalen-2-ol

1-phenyldiazenylnaphthalen-2-ol (PubChem CID 13297) has the molecular formula C16H12N2O and a molecular weight of 248.29 g/mol. Its IUPAC name is 1-phenyldiazenylnaphthalen-2-ol.

Molecular Properties

Compound Name1-phenyldiazenylnaphthalen-2-ol
PubChem CID13297
Molecular FormulaC16H12N2O
Molecular Weight248.29 g/mol
Exact Mass248.09
IUPAC Name1-phenyldiazenylnaphthalen-2-ol
SMILESOc1ccc2ccccc2c1/N=N/c1ccccc1
InChIInChI=1S/C16H12N2O/c19-15-11-10-12-6-4-5-9-14(12)16(15)18-17-13-7-2-1-3-8-13/h1-11,19H/b18-17+
InChIKeyMRQIXHXHHPWVIL-ISLYRVAYSA-N
XLogP4.96
TPSA44.95 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.29
LogP ≤ 54.96
H-Bond Donors ≤ 51
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 1-phenyldiazenylnaphthalen-2-ol?
The IUPAC name of 1-phenyldiazenylnaphthalen-2-ol (CID 13297) is 1-phenyldiazenylnaphthalen-2-ol.
What is the SMILES notation for 1-phenyldiazenylnaphthalen-2-ol?
The canonical SMILES for 1-phenyldiazenylnaphthalen-2-ol is Oc1ccc2ccccc2c1/N=N/c1ccccc1.
What is the InChIKey of 1-phenyldiazenylnaphthalen-2-ol?
The InChIKey is MRQIXHXHHPWVIL-ISLYRVAYSA-N. The full InChI is InChI=1S/C16H12N2O/c19-15-11-10-12-6-4-5-9-14(12)16(15)18-17-13-7-2-1-3-8-13/h1-11,19H/b18-17+.
What are the key properties of 1-phenyldiazenylnaphthalen-2-ol?
1-phenyldiazenylnaphthalen-2-ol has a molecular weight of 248.29 g/mol, XLogP of 4.96, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyldiazenylnaphthalen-2-ol is sourced from PubChem (CID 13297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).