7-bromo-8-ethenyl-2-methoxyquinoline

C12H10BrNO — CID 67131232

IUPAC7-bromo-8-ethenyl-2-methoxyquinoline
SMILESC=Cc1c(Br)ccc2ccc(OC)nc12
InChIInChI=1S/C12H10BrNO/c1-3-9-10(13)6-4-8-5-7-11(15-2)14-12(8)9/h3-7H,1H2,2H3
InChIKeyPWFGEVYIBAJVBG-UHFFFAOYSA-N
MW264.12 g/mol
LogP3.65
Rot. Bonds2

About 7-bromo-8-ethenyl-2-methoxyquinoline

7-bromo-8-ethenyl-2-methoxyquinoline (PubChem CID 67131232) has the molecular formula C12H10BrNO and a molecular weight of 264.12 g/mol. Its IUPAC name is 7-bromo-8-ethenyl-2-methoxyquinoline.

Molecular Properties

Compound Name7-bromo-8-ethenyl-2-methoxyquinoline
PubChem CID67131232
Molecular FormulaC12H10BrNO
Molecular Weight264.12 g/mol
Exact Mass262.99
IUPAC Name7-bromo-8-ethenyl-2-methoxyquinoline
SMILESC=Cc1c(Br)ccc2ccc(OC)nc12
InChIInChI=1S/C12H10BrNO/c1-3-9-10(13)6-4-8-5-7-11(15-2)14-12(8)9/h3-7H,1H2,2H3
InChIKeyPWFGEVYIBAJVBG-UHFFFAOYSA-N
XLogP3.65
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.12
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-bromo-8-ethenyl-2-methoxyquinoline?
The IUPAC name of 7-bromo-8-ethenyl-2-methoxyquinoline (CID 67131232) is 7-bromo-8-ethenyl-2-methoxyquinoline.
What is the SMILES notation for 7-bromo-8-ethenyl-2-methoxyquinoline?
The canonical SMILES for 7-bromo-8-ethenyl-2-methoxyquinoline is C=Cc1c(Br)ccc2ccc(OC)nc12.
What is the InChIKey of 7-bromo-8-ethenyl-2-methoxyquinoline?
The InChIKey is PWFGEVYIBAJVBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrNO/c1-3-9-10(13)6-4-8-5-7-11(15-2)14-12(8)9/h3-7H,1H2,2H3.
What are the key properties of 7-bromo-8-ethenyl-2-methoxyquinoline?
7-bromo-8-ethenyl-2-methoxyquinoline has a molecular weight of 264.12 g/mol, XLogP of 3.65, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-8-ethenyl-2-methoxyquinoline is sourced from PubChem (CID 67131232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).