2-[(E)-2-(2,6-difluorophenyl)ethenyl]quinoline

C17H11F2N — CID 6224185

IUPAC2-[(E)-2-(2,6-difluorophenyl)ethenyl]quinoline
SMILESFc1cccc(F)c1/C=C/c1ccc2ccccc2n1
InChIInChI=1S/C17H11F2N/c18-15-5-3-6-16(19)14(15)11-10-13-9-8-12-4-1-2-7-17(12)20-13/h1-11H/b11-10+
InChIKeyWSACSADFZCIBQG-ZHACJKMWSA-N
MW267.28 g/mol
LogP4.68
Rot. Bonds2

About 2-[(E)-2-(2,6-difluorophenyl)ethenyl]quinoline

2-[(E)-2-(2,6-difluorophenyl)ethenyl]quinoline (PubChem CID 6224185) has the molecular formula C17H11F2N and a molecular weight of 267.28 g/mol. Its IUPAC name is 2-[(E)-2-(2,6-difluorophenyl)ethenyl]quinoline.

Molecular Properties

Compound Name2-[(E)-2-(2,6-difluorophenyl)ethenyl]quinoline
PubChem CID6224185
Molecular FormulaC17H11F2N
Molecular Weight267.28 g/mol
Exact Mass267.09
IUPAC Name2-[(E)-2-(2,6-difluorophenyl)ethenyl]quinoline
SMILESFc1cccc(F)c1/C=C/c1ccc2ccccc2n1
InChIInChI=1S/C17H11F2N/c18-15-5-3-6-16(19)14(15)11-10-13-9-8-12-4-1-2-7-17(12)20-13/h1-11H/b11-10+
InChIKeyWSACSADFZCIBQG-ZHACJKMWSA-N
XLogP4.68
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.28
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-(2,6-difluorophenyl)ethenyl]quinoline?
The IUPAC name of 2-[(E)-2-(2,6-difluorophenyl)ethenyl]quinoline (CID 6224185) is 2-[(E)-2-(2,6-difluorophenyl)ethenyl]quinoline.
What is the SMILES notation for 2-[(E)-2-(2,6-difluorophenyl)ethenyl]quinoline?
The canonical SMILES for 2-[(E)-2-(2,6-difluorophenyl)ethenyl]quinoline is Fc1cccc(F)c1/C=C/c1ccc2ccccc2n1.
What is the InChIKey of 2-[(E)-2-(2,6-difluorophenyl)ethenyl]quinoline?
The InChIKey is WSACSADFZCIBQG-ZHACJKMWSA-N. The full InChI is InChI=1S/C17H11F2N/c18-15-5-3-6-16(19)14(15)11-10-13-9-8-12-4-1-2-7-17(12)20-13/h1-11H/b11-10+.
What are the key properties of 2-[(E)-2-(2,6-difluorophenyl)ethenyl]quinoline?
2-[(E)-2-(2,6-difluorophenyl)ethenyl]quinoline has a molecular weight of 267.28 g/mol, XLogP of 4.68, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-(2,6-difluorophenyl)ethenyl]quinoline is sourced from PubChem (CID 6224185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).