3-bromo-2-(4-methylpentan-2-yloxy)pyridine

C11H16BrNO — CID 61373380

IUPAC3-bromo-2-(4-methylpentan-2-yloxy)pyridine
SMILESCC(C)CC(C)Oc1ncccc1Br
InChIInChI=1S/C11H16BrNO/c1-8(2)7-9(3)14-11-10(12)5-4-6-13-11/h4-6,8-9H,7H2,1-3H3
InChIKeyWIWZZUHFGIKHTE-UHFFFAOYSA-N
MW258.16 g/mol
LogP3.66
Rot. Bonds4

About 3-bromo-2-(4-methylpentan-2-yloxy)pyridine

3-bromo-2-(4-methylpentan-2-yloxy)pyridine (PubChem CID 61373380) has the molecular formula C11H16BrNO and a molecular weight of 258.16 g/mol. Its IUPAC name is 3-bromo-2-(4-methylpentan-2-yloxy)pyridine.

Molecular Properties

Compound Name3-bromo-2-(4-methylpentan-2-yloxy)pyridine
PubChem CID61373380
Molecular FormulaC11H16BrNO
Molecular Weight258.16 g/mol
Exact Mass257.04
IUPAC Name3-bromo-2-(4-methylpentan-2-yloxy)pyridine
SMILESCC(C)CC(C)Oc1ncccc1Br
InChIInChI=1S/C11H16BrNO/c1-8(2)7-9(3)14-11-10(12)5-4-6-13-11/h4-6,8-9H,7H2,1-3H3
InChIKeyWIWZZUHFGIKHTE-UHFFFAOYSA-N
XLogP3.66
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.16
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-2-but-3-yn-2-yloxypyridine
CID 106795101
N'-hydroxy-2-(4-methylpentan-2-yloxy)pyridine-3-carboximidamide
CID 24705092
[3-fluoro-2-(4-methylpentan-2-yloxy)-4-pyridinyl]methanamine
CID 105390800
5-[(3-bromo-2-pyridinyl)oxy]-N-methyl-N-(2-methylpropyl)pyrimidin-2-amine
CID 170993860
3-chloro-2-(4-methylpentan-2-yloxy)pyridine-4-carbonitrile
CID 107058766
2-[(3-bromo-2-pyridinyl)oxy]ethanol
CID 58241926
[(2R)-1-[(3-bromo-2-pyridinyl)oxy]propan-2-yl]-tert-butylcarbamic acid
CID 134249329
3-[(3-bromo-2-pyridinyl)oxy]propan-1-ol
CID 61375068
3-bromo-2-(4-bromo-2-propan-2-ylphenoxy)pyridine
CID 115402194
3-bromo-2-(2-methoxyphenoxy)pyridine
CID 61375067
2-(1-methoxypropan-2-yloxy)pyridine-3-sulfonyl chloride
CID 112573083
2-pentan-2-yloxypyridine-3-carboxylic acid
CID 102980912

Frequently Asked Questions

What is the IUPAC name of 3-bromo-2-(4-methylpentan-2-yloxy)pyridine?
The IUPAC name of 3-bromo-2-(4-methylpentan-2-yloxy)pyridine (CID 61373380) is 3-bromo-2-(4-methylpentan-2-yloxy)pyridine.
What is the SMILES notation for 3-bromo-2-(4-methylpentan-2-yloxy)pyridine?
The canonical SMILES for 3-bromo-2-(4-methylpentan-2-yloxy)pyridine is CC(C)CC(C)Oc1ncccc1Br.
What is the InChIKey of 3-bromo-2-(4-methylpentan-2-yloxy)pyridine?
The InChIKey is WIWZZUHFGIKHTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16BrNO/c1-8(2)7-9(3)14-11-10(12)5-4-6-13-11/h4-6,8-9H,7H2,1-3H3.
What are the key properties of 3-bromo-2-(4-methylpentan-2-yloxy)pyridine?
3-bromo-2-(4-methylpentan-2-yloxy)pyridine has a molecular weight of 258.16 g/mol, XLogP of 3.66, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-2-(4-methylpentan-2-yloxy)pyridine is sourced from PubChem (CID 61373380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).