8-[(2-bromo-5-methoxyphenyl)methoxy]quinoline

C17H14BrNO2 — CID 25270942

IUPAC8-[(2-bromo-5-methoxyphenyl)methoxy]quinoline
SMILESCOc1ccc(Br)c(COc2cccc3cccnc23)c1
InChIInChI=1S/C17H14BrNO2/c1-20-14-7-8-15(18)13(10-14)11-21-16-6-2-4-12-5-3-9-19-17(12)16/h2-10H,11H2,1H3
InChIKeyMFVDURZVANDFIP-UHFFFAOYSA-N
MW344.21 g/mol
LogP4.58
Rot. Bonds4

About 8-[(2-bromo-5-methoxyphenyl)methoxy]quinoline

8-[(2-bromo-5-methoxyphenyl)methoxy]quinoline (PubChem CID 25270942) has the molecular formula C17H14BrNO2 and a molecular weight of 344.21 g/mol. Its IUPAC name is 8-[(2-bromo-5-methoxyphenyl)methoxy]quinoline.

Molecular Properties

Compound Name8-[(2-bromo-5-methoxyphenyl)methoxy]quinoline
PubChem CID25270942
Molecular FormulaC17H14BrNO2
Molecular Weight344.21 g/mol
Exact Mass343.02
IUPAC Name8-[(2-bromo-5-methoxyphenyl)methoxy]quinoline
SMILESCOc1ccc(Br)c(COc2cccc3cccnc23)c1
InChIInChI=1S/C17H14BrNO2/c1-20-14-7-8-15(18)13(10-14)11-21-16-6-2-4-12-5-3-9-19-17(12)16/h2-10H,11H2,1H3
InChIKeyMFVDURZVANDFIP-UHFFFAOYSA-N
XLogP4.58
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.21
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-bromo-2-[(2,3-dichlorophenoxy)methyl]-4-methoxybenzene
CID 65326523
1-[(2-bromo-5-methoxyphenyl)methoxy]-5-methoxynaphthalene
CID 22728210
3-[(2-bromo-5-methoxyphenyl)methoxy]-2-(2-phenylethynyl)pyridine
CID 139229550
3-[(2-bromo-5-methoxyphenyl)methoxy]-2-[2-(4-ethoxyphenyl)ethynyl]pyridine
CID 139229556
1-bromo-2-[[2-(bromomethyl)-3-chlorophenoxy]methyl]-4-methoxybenzene
CID 114321028
1-[4-methoxy-2-(quinolin-8-ylmethoxy)phenyl]ethanone
CID 33079900
1-bromo-2-[(2,6-dimethylphenoxy)methyl]-4-methoxybenzene
CID 65326131
1-bromo-2-[(5-fluoro-2-methylphenoxy)methyl]-4-methoxybenzene
CID 102983162
(1S)-1-[2-[(2-bromo-5-methoxyphenyl)methoxy]phenyl]ethanol
CID 65323216
(E)-1-(4-methoxyphenyl)-3-[4-methoxy-3-(quinolin-8-yloxymethyl)phenyl]prop-2-en-1-one
CID 19558622
8-[(5-bromo-2-methylphenoxy)methyl]quinoline
CID 107283970
8-[(4-methoxyphenyl)methoxy]quinoline-6-thiol
CID 175775819

Frequently Asked Questions

What is the IUPAC name of 8-[(2-bromo-5-methoxyphenyl)methoxy]quinoline?
The IUPAC name of 8-[(2-bromo-5-methoxyphenyl)methoxy]quinoline (CID 25270942) is 8-[(2-bromo-5-methoxyphenyl)methoxy]quinoline.
What is the SMILES notation for 8-[(2-bromo-5-methoxyphenyl)methoxy]quinoline?
The canonical SMILES for 8-[(2-bromo-5-methoxyphenyl)methoxy]quinoline is COc1ccc(Br)c(COc2cccc3cccnc23)c1.
What is the InChIKey of 8-[(2-bromo-5-methoxyphenyl)methoxy]quinoline?
The InChIKey is MFVDURZVANDFIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14BrNO2/c1-20-14-7-8-15(18)13(10-14)11-21-16-6-2-4-12-5-3-9-19-17(12)16/h2-10H,11H2,1H3.
What are the key properties of 8-[(2-bromo-5-methoxyphenyl)methoxy]quinoline?
8-[(2-bromo-5-methoxyphenyl)methoxy]quinoline has a molecular weight of 344.21 g/mol, XLogP of 4.58, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(2-bromo-5-methoxyphenyl)methoxy]quinoline is sourced from PubChem (CID 25270942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).