2-[(E)-2-[2-[(2-chlorophenyl)methoxy]phenyl]ethenyl]quinolin-8-ol

C24H18ClNO2 — CID 6273500

IUPAC2-[(E)-2-[2-[(2-chlorophenyl)methoxy]phenyl]ethenyl]quinolin-8-ol
SMILESOc1cccc2ccc(/C=C/c3ccccc3OCc3ccccc3Cl)nc12
InChIInChI=1S/C24H18ClNO2/c25-21-9-3-1-7-19(21)16-28-23-11-4-2-6-17(23)12-14-20-15-13-18-8-5-10-22(27)24(18)26-20/h1-15,27H,16H2/b14-12+
InChIKeyKNCKGFQSMLPZLS-WYMLVPIESA-N
MW387.87 g/mol
LogP6.34
Rot. Bonds5

About 2-[(E)-2-[2-[(2-chlorophenyl)methoxy]phenyl]ethenyl]quinolin-8-ol

2-[(E)-2-[2-[(2-chlorophenyl)methoxy]phenyl]ethenyl]quinolin-8-ol (PubChem CID 6273500) has the molecular formula C24H18ClNO2 and a molecular weight of 387.87 g/mol. Its IUPAC name is 2-[(E)-2-[2-[(2-chlorophenyl)methoxy]phenyl]ethenyl]quinolin-8-ol.

Molecular Properties

Compound Name2-[(E)-2-[2-[(2-chlorophenyl)methoxy]phenyl]ethenyl]quinolin-8-ol
PubChem CID6273500
Molecular FormulaC24H18ClNO2
Molecular Weight387.87 g/mol
Exact Mass387.10
IUPAC Name2-[(E)-2-[2-[(2-chlorophenyl)methoxy]phenyl]ethenyl]quinolin-8-ol
SMILESOc1cccc2ccc(/C=C/c3ccccc3OCc3ccccc3Cl)nc12
InChIInChI=1S/C24H18ClNO2/c25-21-9-3-1-7-19(21)16-28-23-11-4-2-6-17(23)12-14-20-15-13-18-8-5-10-22(27)24(18)26-20/h1-15,27H,16H2/b14-12+
InChIKeyKNCKGFQSMLPZLS-WYMLVPIESA-N
XLogP6.34
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.87
LogP ≤ 56.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-[2-[(2-chlorophenyl)methoxy]phenyl]ethenyl]quinolin-8-ol?
The IUPAC name of 2-[(E)-2-[2-[(2-chlorophenyl)methoxy]phenyl]ethenyl]quinolin-8-ol (CID 6273500) is 2-[(E)-2-[2-[(2-chlorophenyl)methoxy]phenyl]ethenyl]quinolin-8-ol.
What is the SMILES notation for 2-[(E)-2-[2-[(2-chlorophenyl)methoxy]phenyl]ethenyl]quinolin-8-ol?
The canonical SMILES for 2-[(E)-2-[2-[(2-chlorophenyl)methoxy]phenyl]ethenyl]quinolin-8-ol is Oc1cccc2ccc(/C=C/c3ccccc3OCc3ccccc3Cl)nc12.
What is the InChIKey of 2-[(E)-2-[2-[(2-chlorophenyl)methoxy]phenyl]ethenyl]quinolin-8-ol?
The InChIKey is KNCKGFQSMLPZLS-WYMLVPIESA-N. The full InChI is InChI=1S/C24H18ClNO2/c25-21-9-3-1-7-19(21)16-28-23-11-4-2-6-17(23)12-14-20-15-13-18-8-5-10-22(27)24(18)26-20/h1-15,27H,16H2/b14-12+.
What are the key properties of 2-[(E)-2-[2-[(2-chlorophenyl)methoxy]phenyl]ethenyl]quinolin-8-ol?
2-[(E)-2-[2-[(2-chlorophenyl)methoxy]phenyl]ethenyl]quinolin-8-ol has a molecular weight of 387.87 g/mol, XLogP of 6.34, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-[2-[(2-chlorophenyl)methoxy]phenyl]ethenyl]quinolin-8-ol is sourced from PubChem (CID 6273500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).