3-bromo-2-(3-ethylphenoxy)-4-methylpyridine

C14H14BrNO — CID 106877847

IUPAC3-bromo-2-(3-ethylphenoxy)-4-methylpyridine
SMILESCCc1cccc(Oc2nccc(C)c2Br)c1
InChIInChI=1S/C14H14BrNO/c1-3-11-5-4-6-12(9-11)17-14-13(15)10(2)7-8-16-14/h4-9H,3H2,1-2H3
InChIKeyHQWFZXIETQGURH-UHFFFAOYSA-N
MW292.18 g/mol
LogP4.51
Rot. Bonds3

About 3-bromo-2-(3-ethylphenoxy)-4-methylpyridine

3-bromo-2-(3-ethylphenoxy)-4-methylpyridine (PubChem CID 106877847) has the molecular formula C14H14BrNO and a molecular weight of 292.18 g/mol. Its IUPAC name is 3-bromo-2-(3-ethylphenoxy)-4-methylpyridine.

Molecular Properties

Compound Name3-bromo-2-(3-ethylphenoxy)-4-methylpyridine
PubChem CID106877847
Molecular FormulaC14H14BrNO
Molecular Weight292.18 g/mol
Exact Mass291.03
IUPAC Name3-bromo-2-(3-ethylphenoxy)-4-methylpyridine
SMILESCCc1cccc(Oc2nccc(C)c2Br)c1
InChIInChI=1S/C14H14BrNO/c1-3-11-5-4-6-12(9-11)17-14-13(15)10(2)7-8-16-14/h4-9H,3H2,1-2H3
InChIKeyHQWFZXIETQGURH-UHFFFAOYSA-N
XLogP4.51
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.18
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-2-(3-ethoxyphenoxy)-4-methylpyridine
CID 106877996
3-bromo-4-methyl-2-(3-nitrophenoxy)pyridine
CID 106877947
3-bromo-2-(2-ethylphenoxy)-4-methylpyridine
CID 106877891
3-bromo-4-methyl-2-(4-propoxyphenoxy)pyridine
CID 106877873
[2-(3-ethylphenoxy)-3-pyridinyl]methanamine
CID 24706317
[2-(3-ethylphenoxy)-3-pyridinyl]methanol
CID 61257308
3-bromo-4-methyl-2-[4-(2-methylbutan-2-yl)phenoxy]pyridine
CID 106877752
4-(3-ethylphenoxy)-N,5-dimethylpyrimidin-2-amine
CID 80860603
3-bromo-4-methyl-2-(2-methylphenoxy)pyridine
CID 106877761
3-bromo-4-methyl-2-[(6-methyl-3-pyridinyl)oxy]pyridine
CID 106877981
3-bromo-2-(3-bromo-5-fluorophenoxy)-4-methylpyridine
CID 106875367
1-[5-bromo-2-(3-ethylphenoxy)-3-pyridinyl]-N-methylmethanamine
CID 62297750

Frequently Asked Questions

What is the IUPAC name of 3-bromo-2-(3-ethylphenoxy)-4-methylpyridine?
The IUPAC name of 3-bromo-2-(3-ethylphenoxy)-4-methylpyridine (CID 106877847) is 3-bromo-2-(3-ethylphenoxy)-4-methylpyridine.
What is the SMILES notation for 3-bromo-2-(3-ethylphenoxy)-4-methylpyridine?
The canonical SMILES for 3-bromo-2-(3-ethylphenoxy)-4-methylpyridine is CCc1cccc(Oc2nccc(C)c2Br)c1.
What is the InChIKey of 3-bromo-2-(3-ethylphenoxy)-4-methylpyridine?
The InChIKey is HQWFZXIETQGURH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrNO/c1-3-11-5-4-6-12(9-11)17-14-13(15)10(2)7-8-16-14/h4-9H,3H2,1-2H3.
What are the key properties of 3-bromo-2-(3-ethylphenoxy)-4-methylpyridine?
3-bromo-2-(3-ethylphenoxy)-4-methylpyridine has a molecular weight of 292.18 g/mol, XLogP of 4.51, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-2-(3-ethylphenoxy)-4-methylpyridine is sourced from PubChem (CID 106877847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).