3-bromo-5-(oxetan-3-yloxy)pyridine

C8H8BrNO2 — CID 115669745

IUPAC3-bromo-5-(oxetan-3-yloxy)pyridine
SMILESBrc1cncc(OC2COC2)c1
InChIInChI=1S/C8H8BrNO2/c9-6-1-7(3-10-2-6)12-8-4-11-5-8/h1-3,8H,4-5H2
InChIKeyMBOUWEOKJVZSTK-UHFFFAOYSA-N
MW230.06 g/mol
LogP1.62
Rot. Bonds2

About 3-bromo-5-(oxetan-3-yloxy)pyridine

3-bromo-5-(oxetan-3-yloxy)pyridine (PubChem CID 115669745) has the molecular formula C8H8BrNO2 and a molecular weight of 230.06 g/mol. Its IUPAC name is 3-bromo-5-(oxetan-3-yloxy)pyridine.

Molecular Properties

Compound Name3-bromo-5-(oxetan-3-yloxy)pyridine
PubChem CID115669745
Molecular FormulaC8H8BrNO2
Molecular Weight230.06 g/mol
Exact Mass228.97
IUPAC Name3-bromo-5-(oxetan-3-yloxy)pyridine
SMILESBrc1cncc(OC2COC2)c1
InChIInChI=1S/C8H8BrNO2/c9-6-1-7(3-10-2-6)12-8-4-11-5-8/h1-3,8H,4-5H2
InChIKeyMBOUWEOKJVZSTK-UHFFFAOYSA-N
XLogP1.62
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.06
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-5-(3-chlorocyclobutyl)oxypyridine
CID 66345800
3-(3-bromophenoxy)oxetane
CID 83487082
3-bromo-5-(oxetan-3-yloxymethyl)pyridine
CID 102607218
5-bromo-3-methyl-2-(oxetan-3-yloxy)pyridine
CID 102607188
5-bromo-6-(oxetan-3-yloxy)pyridin-3-amine
CID 102605464
2-[3-[(5-bromo-3-pyridinyl)oxy]pyrrolidin-1-yl]-1,3-oxazole-4-carboxylic acid
CID 166258912
3-[3-[(5-bromo-3-pyridinyl)oxy]pyrrolidin-1-yl]-1-methylpyrrolidin-2-one
CID 126828784
3-(3,5-dichlorophenoxy)oxetane
CID 130653850
5-bromo-2-(oxetan-3-yloxy)-1,3-thiazole
CID 172992254
4-[(3R)-3-[(5-bromo-3-pyridinyl)oxy]pyrrolidin-1-yl]-2-methylpyrimidine
CID 125423872
3-[(5-bromo-3-pyridinyl)oxy]-2-ethoxy-N-ethylcyclobutan-1-amine
CID 113440038
methyl 5-[(3R)-oxolan-3-yl]oxypyridine-3-carboxylate
CID 177196861

Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-(oxetan-3-yloxy)pyridine?
The IUPAC name of 3-bromo-5-(oxetan-3-yloxy)pyridine (CID 115669745) is 3-bromo-5-(oxetan-3-yloxy)pyridine.
What is the SMILES notation for 3-bromo-5-(oxetan-3-yloxy)pyridine?
The canonical SMILES for 3-bromo-5-(oxetan-3-yloxy)pyridine is Brc1cncc(OC2COC2)c1.
What is the InChIKey of 3-bromo-5-(oxetan-3-yloxy)pyridine?
The InChIKey is MBOUWEOKJVZSTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8BrNO2/c9-6-1-7(3-10-2-6)12-8-4-11-5-8/h1-3,8H,4-5H2.
What are the key properties of 3-bromo-5-(oxetan-3-yloxy)pyridine?
3-bromo-5-(oxetan-3-yloxy)pyridine has a molecular weight of 230.06 g/mol, XLogP of 1.62, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-5-(oxetan-3-yloxy)pyridine is sourced from PubChem (CID 115669745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).