2-[(Z)-2-bromoethenyl]-6-fluoroquinoline

C11H7BrFN — CID 86683113

IUPAC2-[(Z)-2-bromoethenyl]-6-fluoroquinoline
SMILESFc1ccc2nc(/C=C\Br)ccc2c1
InChIInChI=1S/C11H7BrFN/c12-6-5-10-3-1-8-7-9(13)2-4-11(8)14-10/h1-7H/b6-5-
InChIKeyYHDKRZUXEDUUSC-WAYWQWQTSA-N
MW252.09 g/mol
LogP3.74
Rot. Bonds1

About 2-[(Z)-2-bromoethenyl]-6-fluoroquinoline

2-[(Z)-2-bromoethenyl]-6-fluoroquinoline (PubChem CID 86683113) has the molecular formula C11H7BrFN and a molecular weight of 252.09 g/mol. Its IUPAC name is 2-[(Z)-2-bromoethenyl]-6-fluoroquinoline.

Molecular Properties

Compound Name2-[(Z)-2-bromoethenyl]-6-fluoroquinoline
PubChem CID86683113
Molecular FormulaC11H7BrFN
Molecular Weight252.09 g/mol
Exact Mass250.97
IUPAC Name2-[(Z)-2-bromoethenyl]-6-fluoroquinoline
SMILESFc1ccc2nc(/C=C\Br)ccc2c1
InChIInChI=1S/C11H7BrFN/c12-6-5-10-3-1-8-7-9(13)2-4-11(8)14-10/h1-7H/b6-5-
InChIKeyYHDKRZUXEDUUSC-WAYWQWQTSA-N
XLogP3.74
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.09
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-2-bromoethenyl]-6-fluoroquinoline?
The IUPAC name of 2-[(Z)-2-bromoethenyl]-6-fluoroquinoline (CID 86683113) is 2-[(Z)-2-bromoethenyl]-6-fluoroquinoline.
What is the SMILES notation for 2-[(Z)-2-bromoethenyl]-6-fluoroquinoline?
The canonical SMILES for 2-[(Z)-2-bromoethenyl]-6-fluoroquinoline is Fc1ccc2nc(/C=C\Br)ccc2c1.
What is the InChIKey of 2-[(Z)-2-bromoethenyl]-6-fluoroquinoline?
The InChIKey is YHDKRZUXEDUUSC-WAYWQWQTSA-N. The full InChI is InChI=1S/C11H7BrFN/c12-6-5-10-3-1-8-7-9(13)2-4-11(8)14-10/h1-7H/b6-5-.
What are the key properties of 2-[(Z)-2-bromoethenyl]-6-fluoroquinoline?
2-[(Z)-2-bromoethenyl]-6-fluoroquinoline has a molecular weight of 252.09 g/mol, XLogP of 3.74, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-2-bromoethenyl]-6-fluoroquinoline is sourced from PubChem (CID 86683113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).