2-[(E)-2-(2-methoxyphenyl)ethenyl]quinoline

C18H15NO — CID 6279093

IUPAC2-[(E)-2-(2-methoxyphenyl)ethenyl]quinoline
SMILESCOc1ccccc1/C=C/c1ccc2ccccc2n1
InChIInChI=1S/C18H15NO/c1-20-18-9-5-3-7-15(18)11-13-16-12-10-14-6-2-4-8-17(14)19-16/h2-13H,1H3/b13-11+
InChIKeyCRKXXGYVXSKYIV-ACCUITESSA-N
MW261.32 g/mol
LogP4.41
Rot. Bonds3

About 2-[(E)-2-(2-methoxyphenyl)ethenyl]quinoline

2-[(E)-2-(2-methoxyphenyl)ethenyl]quinoline (PubChem CID 6279093) has the molecular formula C18H15NO and a molecular weight of 261.32 g/mol. Its IUPAC name is 2-[(E)-2-(2-methoxyphenyl)ethenyl]quinoline.

Molecular Properties

Compound Name2-[(E)-2-(2-methoxyphenyl)ethenyl]quinoline
PubChem CID6279093
Molecular FormulaC18H15NO
Molecular Weight261.32 g/mol
Exact Mass261.12
IUPAC Name2-[(E)-2-(2-methoxyphenyl)ethenyl]quinoline
SMILESCOc1ccccc1/C=C/c1ccc2ccccc2n1
InChIInChI=1S/C18H15NO/c1-20-18-9-5-3-7-15(18)11-13-16-12-10-14-6-2-4-8-17(14)19-16/h2-13H,1H3/b13-11+
InChIKeyCRKXXGYVXSKYIV-ACCUITESSA-N
XLogP4.41
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-(2-methoxyphenyl)ethenyl]quinoline?
The IUPAC name of 2-[(E)-2-(2-methoxyphenyl)ethenyl]quinoline (CID 6279093) is 2-[(E)-2-(2-methoxyphenyl)ethenyl]quinoline.
What is the SMILES notation for 2-[(E)-2-(2-methoxyphenyl)ethenyl]quinoline?
The canonical SMILES for 2-[(E)-2-(2-methoxyphenyl)ethenyl]quinoline is COc1ccccc1/C=C/c1ccc2ccccc2n1.
What is the InChIKey of 2-[(E)-2-(2-methoxyphenyl)ethenyl]quinoline?
The InChIKey is CRKXXGYVXSKYIV-ACCUITESSA-N. The full InChI is InChI=1S/C18H15NO/c1-20-18-9-5-3-7-15(18)11-13-16-12-10-14-6-2-4-8-17(14)19-16/h2-13H,1H3/b13-11+.
What are the key properties of 2-[(E)-2-(2-methoxyphenyl)ethenyl]quinoline?
2-[(E)-2-(2-methoxyphenyl)ethenyl]quinoline has a molecular weight of 261.32 g/mol, XLogP of 4.41, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-(2-methoxyphenyl)ethenyl]quinoline is sourced from PubChem (CID 6279093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).