2-[(E)-2-(4-hydroxyphenyl)ethenyl]quinolin-8-ol

C17H13NO2 — CID 135500760

IUPAC2-[(E)-2-(4-hydroxyphenyl)ethenyl]quinolin-8-ol
SMILESOc1ccc(/C=C/c2ccc3cccc(O)c3n2)cc1
InChIInChI=1S/C17H13NO2/c19-15-10-5-12(6-11-15)4-8-14-9-7-13-2-1-3-16(20)17(13)18-14/h1-11,19-20H/b8-4+
InChIKeyYMSHSKJZBZKCOR-XBXARRHUSA-N
MW263.30 g/mol
LogP3.82
Rot. Bonds2

About 2-[(E)-2-(4-hydroxyphenyl)ethenyl]quinolin-8-ol

2-[(E)-2-(4-hydroxyphenyl)ethenyl]quinolin-8-ol (PubChem CID 135500760) has the molecular formula C17H13NO2 and a molecular weight of 263.30 g/mol. Its IUPAC name is 2-[(E)-2-(4-hydroxyphenyl)ethenyl]quinolin-8-ol.

Molecular Properties

Compound Name2-[(E)-2-(4-hydroxyphenyl)ethenyl]quinolin-8-ol
PubChem CID135500760
Molecular FormulaC17H13NO2
Molecular Weight263.30 g/mol
Exact Mass263.09
IUPAC Name2-[(E)-2-(4-hydroxyphenyl)ethenyl]quinolin-8-ol
SMILESOc1ccc(/C=C/c2ccc3cccc(O)c3n2)cc1
InChIInChI=1S/C17H13NO2/c19-15-10-5-12(6-11-15)4-8-14-9-7-13-2-1-3-16(20)17(13)18-14/h1-11,19-20H/b8-4+
InChIKeyYMSHSKJZBZKCOR-XBXARRHUSA-N
XLogP3.82
TPSA53.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 53.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-(4-hydroxyphenyl)ethenyl]quinolin-8-ol?
The IUPAC name of 2-[(E)-2-(4-hydroxyphenyl)ethenyl]quinolin-8-ol (CID 135500760) is 2-[(E)-2-(4-hydroxyphenyl)ethenyl]quinolin-8-ol.
What is the SMILES notation for 2-[(E)-2-(4-hydroxyphenyl)ethenyl]quinolin-8-ol?
The canonical SMILES for 2-[(E)-2-(4-hydroxyphenyl)ethenyl]quinolin-8-ol is Oc1ccc(/C=C/c2ccc3cccc(O)c3n2)cc1.
What is the InChIKey of 2-[(E)-2-(4-hydroxyphenyl)ethenyl]quinolin-8-ol?
The InChIKey is YMSHSKJZBZKCOR-XBXARRHUSA-N. The full InChI is InChI=1S/C17H13NO2/c19-15-10-5-12(6-11-15)4-8-14-9-7-13-2-1-3-16(20)17(13)18-14/h1-11,19-20H/b8-4+.
What are the key properties of 2-[(E)-2-(4-hydroxyphenyl)ethenyl]quinolin-8-ol?
2-[(E)-2-(4-hydroxyphenyl)ethenyl]quinolin-8-ol has a molecular weight of 263.30 g/mol, XLogP of 3.82, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-(4-hydroxyphenyl)ethenyl]quinolin-8-ol is sourced from PubChem (CID 135500760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).