4-(2-bromoethoxy)-3,5-dichloro-2,6-dimethylpyridine

C9H10BrCl2NO — CID 572274

IUPAC4-(2-bromoethoxy)-3,5-dichloro-2,6-dimethylpyridine
SMILESCc1nc(C)c(Cl)c(OCCBr)c1Cl
InChIInChI=1S/C9H10BrCl2NO/c1-5-7(11)9(14-4-3-10)8(12)6(2)13-5/h3-4H2,1-2H3
InChIKeyQXGXBQSJXZMLKW-UHFFFAOYSA-N
MW299.00 g/mol
LogP3.78
Rot. Bonds3

About 4-(2-bromoethoxy)-3,5-dichloro-2,6-dimethylpyridine

4-(2-bromoethoxy)-3,5-dichloro-2,6-dimethylpyridine (PubChem CID 572274) has the molecular formula C9H10BrCl2NO and a molecular weight of 299.00 g/mol. Its IUPAC name is 4-(2-bromoethoxy)-3,5-dichloro-2,6-dimethylpyridine.

Molecular Properties

Compound Name4-(2-bromoethoxy)-3,5-dichloro-2,6-dimethylpyridine
PubChem CID572274
Molecular FormulaC9H10BrCl2NO
Molecular Weight299.00 g/mol
Exact Mass296.93
IUPAC Name4-(2-bromoethoxy)-3,5-dichloro-2,6-dimethylpyridine
SMILESCc1nc(C)c(Cl)c(OCCBr)c1Cl
InChIInChI=1S/C9H10BrCl2NO/c1-5-7(11)9(14-4-3-10)8(12)6(2)13-5/h3-4H2,1-2H3
InChIKeyQXGXBQSJXZMLKW-UHFFFAOYSA-N
XLogP3.78
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.00
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

3,5-dichloro-4-ethoxy-2,6-dimethylpyridine
CID 605771
3,5-dichloro-4-[(2-fluorophenyl)methoxy]-2,6-dimethylpyridine
CID 134064703
2-[(3,5-dichloro-2,6-dimethyl-4-pyridinyl)oxy]-1-phenylethanone
CID 134064664
3,5-dichloro-2,6-dimethyl-4-(3-phenylprop-2-ynoxy)pyridine
CID 134066957
3,5-dichloro-4-[(2-chloro-4-fluorophenyl)methoxy]-2,6-dimethylpyridine
CID 134064787
1,3,5-trichloro-2,4,6-tripropoxybenzene
CID 88760261
3-[(3,5-dichloro-2,6-dimethyl-4-pyridinyl)oxy]-N-(2-methoxyphenyl)propanamide
CID 134064601
2-[(2,3,5,6-tetrachloro-4-pyridinyl)oxy]ethanol
CID 13029611
2-[(3,5-dichloro-2,6-dimethyl-4-pyridinyl)oxy]-N-(2-hydroxyphenyl)acetamide
CID 134064912
2-[(3,5-dichloro-2,6-dimethyl-4-pyridinyl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 134064721
trimethyl-[3-(2,3,4,5,6-pentachlorophenoxy)propoxy]silane
CID 18346518
2-(2-bromoethoxy)-1-(3-chlorophenyl)-3-methylbenzene
CID 171037138

Frequently Asked Questions

What is the IUPAC name of 4-(2-bromoethoxy)-3,5-dichloro-2,6-dimethylpyridine?
The IUPAC name of 4-(2-bromoethoxy)-3,5-dichloro-2,6-dimethylpyridine (CID 572274) is 4-(2-bromoethoxy)-3,5-dichloro-2,6-dimethylpyridine.
What is the SMILES notation for 4-(2-bromoethoxy)-3,5-dichloro-2,6-dimethylpyridine?
The canonical SMILES for 4-(2-bromoethoxy)-3,5-dichloro-2,6-dimethylpyridine is Cc1nc(C)c(Cl)c(OCCBr)c1Cl.
What is the InChIKey of 4-(2-bromoethoxy)-3,5-dichloro-2,6-dimethylpyridine?
The InChIKey is QXGXBQSJXZMLKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10BrCl2NO/c1-5-7(11)9(14-4-3-10)8(12)6(2)13-5/h3-4H2,1-2H3.
What are the key properties of 4-(2-bromoethoxy)-3,5-dichloro-2,6-dimethylpyridine?
4-(2-bromoethoxy)-3,5-dichloro-2,6-dimethylpyridine has a molecular weight of 299.00 g/mol, XLogP of 3.78, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-bromoethoxy)-3,5-dichloro-2,6-dimethylpyridine is sourced from PubChem (CID 572274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).