3-bromo-2-(4-chloro-3-methylphenoxy)-5-methylpyridine

C13H11BrClNO — CID 105368164

IUPAC3-bromo-2-(4-chloro-3-methylphenoxy)-5-methylpyridine
SMILESCc1cnc(Oc2ccc(Cl)c(C)c2)c(Br)c1
InChIInChI=1S/C13H11BrClNO/c1-8-5-11(14)13(16-7-8)17-10-3-4-12(15)9(2)6-10/h3-7H,1-2H3
InChIKeyONNFDTKZHPWFPZ-UHFFFAOYSA-N
MW312.59 g/mol
LogP4.91
Rot. Bonds2

About 3-bromo-2-(4-chloro-3-methylphenoxy)-5-methylpyridine

3-bromo-2-(4-chloro-3-methylphenoxy)-5-methylpyridine (PubChem CID 105368164) has the molecular formula C13H11BrClNO and a molecular weight of 312.59 g/mol. Its IUPAC name is 3-bromo-2-(4-chloro-3-methylphenoxy)-5-methylpyridine.

Molecular Properties

Compound Name3-bromo-2-(4-chloro-3-methylphenoxy)-5-methylpyridine
PubChem CID105368164
Molecular FormulaC13H11BrClNO
Molecular Weight312.59 g/mol
Exact Mass310.97
IUPAC Name3-bromo-2-(4-chloro-3-methylphenoxy)-5-methylpyridine
SMILESCc1cnc(Oc2ccc(Cl)c(C)c2)c(Br)c1
InChIInChI=1S/C13H11BrClNO/c1-8-5-11(14)13(16-7-8)17-10-3-4-12(15)9(2)6-10/h3-7H,1-2H3
InChIKeyONNFDTKZHPWFPZ-UHFFFAOYSA-N
XLogP4.91
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.59
LogP ≤ 54.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-bromo-2-(4-chloro-3-methylphenoxy)-5-methylpyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-bromo-2-(3,4-difluorophenoxy)-5-methylpyridine
CID 105368266
3-bromo-2-(4-fluorophenoxy)-5-methylpyridine
CID 105368202
4-[(3-bromo-5-methyl-2-pyridinyl)oxy]benzonitrile
CID 105368203
3-bromo-2-(2,3-dichlorophenoxy)-5-methylpyridine
CID 105368244
5-[(3-bromo-5-methyl-2-pyridinyl)oxy]-2-methoxyaniline
CID 103201979
3-bromo-2-(2-bromo-4-chlorophenoxy)-5-methylpyridine
CID 105368214
3-bromo-5-chloro-2-(3-methylphenoxy)pyridine
CID 114837538
2-[(3-bromo-5-methyl-2-pyridinyl)oxy]-5-methoxyaniline
CID 105367213
5-amino-2-(4-chloro-3-methylphenoxy)pyridine-3-carboxylic acid
CID 114047540
2-[(3-bromo-5-methyl-2-pyridinyl)oxy]phenol
CID 105367477
5-bromo-3-chloro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine
CID 103583561
4-(4-bromo-3-methylphenoxy)-2-chloro-5-methylpyrimidine
CID 83132767

Frequently Asked Questions

What is the IUPAC name of 3-bromo-2-(4-chloro-3-methylphenoxy)-5-methylpyridine?
The IUPAC name of 3-bromo-2-(4-chloro-3-methylphenoxy)-5-methylpyridine (CID 105368164) is 3-bromo-2-(4-chloro-3-methylphenoxy)-5-methylpyridine.
What is the SMILES notation for 3-bromo-2-(4-chloro-3-methylphenoxy)-5-methylpyridine?
The canonical SMILES for 3-bromo-2-(4-chloro-3-methylphenoxy)-5-methylpyridine is Cc1cnc(Oc2ccc(Cl)c(C)c2)c(Br)c1.
What is the InChIKey of 3-bromo-2-(4-chloro-3-methylphenoxy)-5-methylpyridine?
The InChIKey is ONNFDTKZHPWFPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11BrClNO/c1-8-5-11(14)13(16-7-8)17-10-3-4-12(15)9(2)6-10/h3-7H,1-2H3.
What are the key properties of 3-bromo-2-(4-chloro-3-methylphenoxy)-5-methylpyridine?
3-bromo-2-(4-chloro-3-methylphenoxy)-5-methylpyridine has a molecular weight of 312.59 g/mol, XLogP of 4.91, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-2-(4-chloro-3-methylphenoxy)-5-methylpyridine is sourced from PubChem (CID 105368164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).