4-[(E)-2-(3-hydroxyphenyl)ethenyl]-2-pyridin-2-ylphenol

C19H15NO2 — CID 155537569

IUPAC4-[(E)-2-(3-hydroxyphenyl)ethenyl]-2-pyridin-2-ylphenol
SMILESOc1cccc(/C=C/c2ccc(O)c(-c3ccccn3)c2)c1
InChIInChI=1S/C19H15NO2/c21-16-5-3-4-14(12-16)7-8-15-9-10-19(22)17(13-15)18-6-1-2-11-20-18/h1-13,21-22H/b8-7+
InChIKeyOROJKYOJYHXJJK-BQYQJAHWSA-N
MW289.33 g/mol
LogP4.33
Rot. Bonds3

About 4-[(E)-2-(3-hydroxyphenyl)ethenyl]-2-pyridin-2-ylphenol

4-[(E)-2-(3-hydroxyphenyl)ethenyl]-2-pyridin-2-ylphenol (PubChem CID 155537569) has the molecular formula C19H15NO2 and a molecular weight of 289.33 g/mol. Its IUPAC name is 4-[(E)-2-(3-hydroxyphenyl)ethenyl]-2-pyridin-2-ylphenol.

Molecular Properties

Compound Name4-[(E)-2-(3-hydroxyphenyl)ethenyl]-2-pyridin-2-ylphenol
PubChem CID155537569
Molecular FormulaC19H15NO2
Molecular Weight289.33 g/mol
Exact Mass289.11
IUPAC Name4-[(E)-2-(3-hydroxyphenyl)ethenyl]-2-pyridin-2-ylphenol
SMILESOc1cccc(/C=C/c2ccc(O)c(-c3ccccn3)c2)c1
InChIInChI=1S/C19H15NO2/c21-16-5-3-4-14(12-16)7-8-15-9-10-19(22)17(13-15)18-6-1-2-11-20-18/h1-13,21-22H/b8-7+
InChIKeyOROJKYOJYHXJJK-BQYQJAHWSA-N
XLogP4.33
TPSA53.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 54.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-[(E)-2-(3-hydroxyphenyl)ethenyl]-2-pyridin-2-ylphenol?
The IUPAC name of 4-[(E)-2-(3-hydroxyphenyl)ethenyl]-2-pyridin-2-ylphenol (CID 155537569) is 4-[(E)-2-(3-hydroxyphenyl)ethenyl]-2-pyridin-2-ylphenol.
What is the SMILES notation for 4-[(E)-2-(3-hydroxyphenyl)ethenyl]-2-pyridin-2-ylphenol?
The canonical SMILES for 4-[(E)-2-(3-hydroxyphenyl)ethenyl]-2-pyridin-2-ylphenol is Oc1cccc(/C=C/c2ccc(O)c(-c3ccccn3)c2)c1.
What is the InChIKey of 4-[(E)-2-(3-hydroxyphenyl)ethenyl]-2-pyridin-2-ylphenol?
The InChIKey is OROJKYOJYHXJJK-BQYQJAHWSA-N. The full InChI is InChI=1S/C19H15NO2/c21-16-5-3-4-14(12-16)7-8-15-9-10-19(22)17(13-15)18-6-1-2-11-20-18/h1-13,21-22H/b8-7+.
What are the key properties of 4-[(E)-2-(3-hydroxyphenyl)ethenyl]-2-pyridin-2-ylphenol?
4-[(E)-2-(3-hydroxyphenyl)ethenyl]-2-pyridin-2-ylphenol has a molecular weight of 289.33 g/mol, XLogP of 4.33, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-2-(3-hydroxyphenyl)ethenyl]-2-pyridin-2-ylphenol is sourced from PubChem (CID 155537569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).