2-[(3-bromo-2-pyridinyl)oxy]ethanol

C7H8BrNO2 — CID 58241926

IUPAC2-[(3-bromo-2-pyridinyl)oxy]ethanol
SMILESOCCOc1ncccc1Br
InChIInChI=1S/C7H8BrNO2/c8-6-2-1-3-9-7(6)11-5-4-10/h1-3,10H,4-5H2
InChIKeyOYHCSVAQQLLOLR-UHFFFAOYSA-N
MW218.05 g/mol
LogP1.22
Rot. Bonds3

About 2-[(3-bromo-2-pyridinyl)oxy]ethanol

2-[(3-bromo-2-pyridinyl)oxy]ethanol (PubChem CID 58241926) has the molecular formula C7H8BrNO2 and a molecular weight of 218.05 g/mol. Its IUPAC name is 2-[(3-bromo-2-pyridinyl)oxy]ethanol.

Molecular Properties

Compound Name2-[(3-bromo-2-pyridinyl)oxy]ethanol
PubChem CID58241926
Molecular FormulaC7H8BrNO2
Molecular Weight218.05 g/mol
Exact Mass216.97
IUPAC Name2-[(3-bromo-2-pyridinyl)oxy]ethanol
SMILESOCCOc1ncccc1Br
InChIInChI=1S/C7H8BrNO2/c8-6-2-1-3-9-7(6)11-5-4-10/h1-3,10H,4-5H2
InChIKeyOYHCSVAQQLLOLR-UHFFFAOYSA-N
XLogP1.22
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.05
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(3-bromo-2-pyridinyl)oxy]propan-1-ol
CID 61375068
3-bromo-2-(4,4,4-trifluorobutoxy)pyridine
CID 82788804
2-[(2-bromo-3-pyridinyl)oxy]ethanol
CID 22036263
3-bromo-2-(2-cyclobutylethoxy)pyridine
CID 106203696
3-bromo-2-(2-piperidin-1-ylethoxy)pyridine
CID 55136336
acetyl cyanide;3-bromo-2-(2-methoxyethoxy)pyridine
CID 118959757
5-[2-[(3-bromo-2-pyridinyl)oxy]ethyl]-4-methyl-1,3-thiazole
CID 61373558
2-[(3-bromo-2-pyridinyl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
CID 134862019
3-bromo-2-(2-pyrrolidin-3-ylethoxy)pyridine
CID 114796523
3-bromo-2-(furan-2-ylmethoxy)pyridine
CID 61373376
[2-(2-bromophenoxy)-3-pyridinyl]methanol
CID 61256696
3-bromo-2-(2-hydroxyethoxy)benzoic acid
CID 61391225

Frequently Asked Questions

What is the IUPAC name of 2-[(3-bromo-2-pyridinyl)oxy]ethanol?
The IUPAC name of 2-[(3-bromo-2-pyridinyl)oxy]ethanol (CID 58241926) is 2-[(3-bromo-2-pyridinyl)oxy]ethanol.
What is the SMILES notation for 2-[(3-bromo-2-pyridinyl)oxy]ethanol?
The canonical SMILES for 2-[(3-bromo-2-pyridinyl)oxy]ethanol is OCCOc1ncccc1Br.
What is the InChIKey of 2-[(3-bromo-2-pyridinyl)oxy]ethanol?
The InChIKey is OYHCSVAQQLLOLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8BrNO2/c8-6-2-1-3-9-7(6)11-5-4-10/h1-3,10H,4-5H2.
What are the key properties of 2-[(3-bromo-2-pyridinyl)oxy]ethanol?
2-[(3-bromo-2-pyridinyl)oxy]ethanol has a molecular weight of 218.05 g/mol, XLogP of 1.22, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-bromo-2-pyridinyl)oxy]ethanol is sourced from PubChem (CID 58241926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).