2-(4-bromo-3-methylphenoxy)-5-chloropyridine

C12H9BrClNO — CID 83132873

IUPAC2-(4-bromo-3-methylphenoxy)-5-chloropyridine
SMILESCc1cc(Oc2ccc(Cl)cn2)ccc1Br
InChIInChI=1S/C12H9BrClNO/c1-8-6-10(3-4-11(8)13)16-12-5-2-9(14)7-15-12/h2-7H,1H3
InChIKeyXXNBQJYGOAWJQY-UHFFFAOYSA-N
MW298.57 g/mol
LogP4.60
Rot. Bonds2

About 2-(4-bromo-3-methylphenoxy)-5-chloropyridine

2-(4-bromo-3-methylphenoxy)-5-chloropyridine (PubChem CID 83132873) has the molecular formula C12H9BrClNO and a molecular weight of 298.57 g/mol. Its IUPAC name is 2-(4-bromo-3-methylphenoxy)-5-chloropyridine.

Molecular Properties

Compound Name2-(4-bromo-3-methylphenoxy)-5-chloropyridine
PubChem CID83132873
Molecular FormulaC12H9BrClNO
Molecular Weight298.57 g/mol
Exact Mass296.96
IUPAC Name2-(4-bromo-3-methylphenoxy)-5-chloropyridine
SMILESCc1cc(Oc2ccc(Cl)cn2)ccc1Br
InChIInChI=1S/C12H9BrClNO/c1-8-6-10(3-4-11(8)13)16-12-5-2-9(14)7-15-12/h2-7H,1H3
InChIKeyXXNBQJYGOAWJQY-UHFFFAOYSA-N
XLogP4.60
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.57
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(4-bromo-3-methylphenoxy)-5-chloropyridine 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

2-(4-bromo-3-methylphenoxy)-5-methylpyridine
CID 83141020
2-(3-bromo-4-fluorophenoxy)-5-chloropyridine
CID 83233863
2-bromo-5-[(5-chloro-2-pyridinyl)oxy]pyridine
CID 118431399
6-(4-bromo-3-methylphenoxy)pyridine-3-carboximidamide
CID 83141115
3-(4-bromo-3-methylphenoxy)-5-methylpyridazine
CID 106549380
4-(4-bromo-3-methylphenoxy)-6-methylpyrimidine
CID 81334328
4-(4-bromo-3-methylphenoxy)-2-chloro-5-methylpyrimidine
CID 83132767
5-chloro-2-(4-propan-2-ylphenoxy)pyridine
CID 66234556
5-chloro-2-(4-ethoxyphenoxy)pyridine
CID 66234109
5-bromo-4-methyl-2-(4-methylphenoxy)pyridine
CID 114870650
5-chloro-2-(3-methoxy-5-methylphenoxy)pyridine
CID 141112024
4-(4-bromo-3-methylphenoxy)-6-methylpyrimidin-2-amine
CID 83135228

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-3-methylphenoxy)-5-chloropyridine?
The IUPAC name of 2-(4-bromo-3-methylphenoxy)-5-chloropyridine (CID 83132873) is 2-(4-bromo-3-methylphenoxy)-5-chloropyridine.
What is the SMILES notation for 2-(4-bromo-3-methylphenoxy)-5-chloropyridine?
The canonical SMILES for 2-(4-bromo-3-methylphenoxy)-5-chloropyridine is Cc1cc(Oc2ccc(Cl)cn2)ccc1Br.
What is the InChIKey of 2-(4-bromo-3-methylphenoxy)-5-chloropyridine?
The InChIKey is XXNBQJYGOAWJQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9BrClNO/c1-8-6-10(3-4-11(8)13)16-12-5-2-9(14)7-15-12/h2-7H,1H3.
What are the key properties of 2-(4-bromo-3-methylphenoxy)-5-chloropyridine?
2-(4-bromo-3-methylphenoxy)-5-chloropyridine has a molecular weight of 298.57 g/mol, XLogP of 4.60, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-3-methylphenoxy)-5-chloropyridine is sourced from PubChem (CID 83132873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).