3-bromo-2-(3-methylcyclobutyl)oxypyridine

C10H12BrNO — CID 122580795

IUPAC3-bromo-2-(3-methylcyclobutyl)oxypyridine
SMILESCC1CC(Oc2ncccc2Br)C1
InChIInChI=1S/C10H12BrNO/c1-7-5-8(6-7)13-10-9(11)3-2-4-12-10/h2-4,7-8H,5-6H2,1H3
InChIKeyQHRQIUNSLWBKAD-UHFFFAOYSA-N
MW242.12 g/mol
LogP3.02
Rot. Bonds2

About 3-bromo-2-(3-methylcyclobutyl)oxypyridine

3-bromo-2-(3-methylcyclobutyl)oxypyridine (PubChem CID 122580795) has the molecular formula C10H12BrNO and a molecular weight of 242.12 g/mol. Its IUPAC name is 3-bromo-2-(3-methylcyclobutyl)oxypyridine.

Molecular Properties

Compound Name3-bromo-2-(3-methylcyclobutyl)oxypyridine
PubChem CID122580795
Molecular FormulaC10H12BrNO
Molecular Weight242.12 g/mol
Exact Mass241.01
IUPAC Name3-bromo-2-(3-methylcyclobutyl)oxypyridine
SMILESCC1CC(Oc2ncccc2Br)C1
InChIInChI=1S/C10H12BrNO/c1-7-5-8(6-7)13-10-9(11)3-2-4-12-10/h2-4,7-8H,5-6H2,1H3
InChIKeyQHRQIUNSLWBKAD-UHFFFAOYSA-N
XLogP3.02
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.12
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-2-(4-methylcyclohexyl)oxypyridine
CID 61373555
2-(azetidin-3-yloxy)-3-bromopyridine
CID 58547749
4-[(3-bromo-2-pyridinyl)oxy]-N,N-dimethylcyclohexan-1-amine
CID 126955057
[3-[(3-bromo-2-pyridinyl)oxy]cyclobutyl]carbamic acid
CID 67478740
3-bromo-2-(thiolan-3-yloxy)pyridine
CID 126955056
3-bromo-2-[(3R)-pyrrolidin-3-yl]oxypyridine
CID 94406855
5-bromo-6-(3,5-dimethylcyclohexyl)oxypyridin-3-amine
CID 79535668
ethane;2-(3-methylcyclobutyl)oxypyridine
CID 169213104
[3-[(3-bromo-2-pyridinyl)oxy]azetidin-1-yl]-cyclopropylmethanone
CID 122249860
[4-[(3-bromo-2-pyridinyl)oxy]piperidin-1-yl]-cyclopropylmethanone
CID 71799453
2-[4-[(3-bromo-2-pyridinyl)oxy]piperidin-1-yl]quinoline
CID 58547880
1-[4-[(3-bromo-2-pyridinyl)oxy]piperidin-1-yl]but-2-en-1-one
CID 91939329

Frequently Asked Questions

What is the IUPAC name of 3-bromo-2-(3-methylcyclobutyl)oxypyridine?
The IUPAC name of 3-bromo-2-(3-methylcyclobutyl)oxypyridine (CID 122580795) is 3-bromo-2-(3-methylcyclobutyl)oxypyridine.
What is the SMILES notation for 3-bromo-2-(3-methylcyclobutyl)oxypyridine?
The canonical SMILES for 3-bromo-2-(3-methylcyclobutyl)oxypyridine is CC1CC(Oc2ncccc2Br)C1.
What is the InChIKey of 3-bromo-2-(3-methylcyclobutyl)oxypyridine?
The InChIKey is QHRQIUNSLWBKAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12BrNO/c1-7-5-8(6-7)13-10-9(11)3-2-4-12-10/h2-4,7-8H,5-6H2,1H3.
What are the key properties of 3-bromo-2-(3-methylcyclobutyl)oxypyridine?
3-bromo-2-(3-methylcyclobutyl)oxypyridine has a molecular weight of 242.12 g/mol, XLogP of 3.02, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-2-(3-methylcyclobutyl)oxypyridine is sourced from PubChem (CID 122580795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).