2-[(E)-2-[2-(pyridin-2-ylmethoxy)phenyl]ethenyl]quinolin-8-ol

C23H18N2O2 — CID 24628167

IUPAC2-[(E)-2-[2-(pyridin-2-ylmethoxy)phenyl]ethenyl]quinolin-8-ol
SMILESOc1cccc2ccc(/C=C/c3ccccc3OCc3ccccn3)nc12
InChIInChI=1S/C23H18N2O2/c26-21-9-5-7-18-12-14-19(25-23(18)21)13-11-17-6-1-2-10-22(17)27-16-20-8-3-4-15-24-20/h1-15,26H,16H2/b13-11+
InChIKeyJKMAYLFYBAYZMT-ACCUITESSA-N
MW354.41 g/mol
LogP5.08
Rot. Bonds5

About 2-[(E)-2-[2-(pyridin-2-ylmethoxy)phenyl]ethenyl]quinolin-8-ol

2-[(E)-2-[2-(pyridin-2-ylmethoxy)phenyl]ethenyl]quinolin-8-ol (PubChem CID 24628167) has the molecular formula C23H18N2O2 and a molecular weight of 354.41 g/mol. Its IUPAC name is 2-[(E)-2-[2-(pyridin-2-ylmethoxy)phenyl]ethenyl]quinolin-8-ol.

Molecular Properties

Compound Name2-[(E)-2-[2-(pyridin-2-ylmethoxy)phenyl]ethenyl]quinolin-8-ol
PubChem CID24628167
Molecular FormulaC23H18N2O2
Molecular Weight354.41 g/mol
Exact Mass354.14
IUPAC Name2-[(E)-2-[2-(pyridin-2-ylmethoxy)phenyl]ethenyl]quinolin-8-ol
SMILESOc1cccc2ccc(/C=C/c3ccccc3OCc3ccccn3)nc12
InChIInChI=1S/C23H18N2O2/c26-21-9-5-7-18-12-14-19(25-23(18)21)13-11-17-6-1-2-10-22(17)27-16-20-8-3-4-15-24-20/h1-15,26H,16H2/b13-11+
InChIKeyJKMAYLFYBAYZMT-ACCUITESSA-N
XLogP5.08
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.41
LogP ≤ 55.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(2-methoxyphenyl)ethenyl]quinolin-8-ol
CID 2907055
2-[2-(2-methylphenyl)ethenyl]quinolin-8-ol
CID 2922355
2-[(E)-2-(5-bromo-2-hydroxy-3-methoxyphenyl)ethenyl]quinolin-8-ol
CID 135500758
ethyl 2-[2-[(Z)-2-(8-phenylmethoxyquinolin-2-yl)ethenyl]phenoxy]acetate
CID 93012870
2-[2-(2-bromo-5-ethoxy-4-hydroxyphenyl)ethenyl]quinolin-8-ol
CID 2966233
2-[(E)-2-(2-methoxyphenyl)ethenyl]pyridine
CID 127035001
2-[(E)-2-(2,4-dimethoxyphenyl)ethenyl]-8-phenylmethoxyquinoline
CID 11839791
2-[(E)-2-(2-ethoxyphenyl)ethenyl]-8-nitroquinoline
CID 6214122
2-[(Z)-2-(3,5-dibromo-2-hydroxyphenyl)ethenyl]quinolin-8-ol
CID 136765269
2-[(E)-2-[2-(pyridin-3-ylmethoxy)phenyl]ethenyl]quinoline
CID 52643093
2-[(E)-2-(4-ethoxy-2-fluorophenyl)ethenyl]quinolin-8-ol
CID 141481161
2-[(E)-2-[2-[(4-bromophenyl)methoxy]phenyl]ethenyl]quinoline
CID 19590683

Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-[2-(pyridin-2-ylmethoxy)phenyl]ethenyl]quinolin-8-ol?
The IUPAC name of 2-[(E)-2-[2-(pyridin-2-ylmethoxy)phenyl]ethenyl]quinolin-8-ol (CID 24628167) is 2-[(E)-2-[2-(pyridin-2-ylmethoxy)phenyl]ethenyl]quinolin-8-ol.
What is the SMILES notation for 2-[(E)-2-[2-(pyridin-2-ylmethoxy)phenyl]ethenyl]quinolin-8-ol?
The canonical SMILES for 2-[(E)-2-[2-(pyridin-2-ylmethoxy)phenyl]ethenyl]quinolin-8-ol is Oc1cccc2ccc(/C=C/c3ccccc3OCc3ccccn3)nc12.
What is the InChIKey of 2-[(E)-2-[2-(pyridin-2-ylmethoxy)phenyl]ethenyl]quinolin-8-ol?
The InChIKey is JKMAYLFYBAYZMT-ACCUITESSA-N. The full InChI is InChI=1S/C23H18N2O2/c26-21-9-5-7-18-12-14-19(25-23(18)21)13-11-17-6-1-2-10-22(17)27-16-20-8-3-4-15-24-20/h1-15,26H,16H2/b13-11+.
What are the key properties of 2-[(E)-2-[2-(pyridin-2-ylmethoxy)phenyl]ethenyl]quinolin-8-ol?
2-[(E)-2-[2-(pyridin-2-ylmethoxy)phenyl]ethenyl]quinolin-8-ol has a molecular weight of 354.41 g/mol, XLogP of 5.08, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-[2-(pyridin-2-ylmethoxy)phenyl]ethenyl]quinolin-8-ol is sourced from PubChem (CID 24628167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).