2-(4-bromophenoxy)-5-methylpyridine

C12H10BrNO — CID 24700025

IUPAC2-(4-bromophenoxy)-5-methylpyridine
SMILESCc1ccc(Oc2ccc(Br)cc2)nc1
InChIInChI=1S/C12H10BrNO/c1-9-2-7-12(14-8-9)15-11-5-3-10(13)4-6-11/h2-8H,1H3
InChIKeyRZXUVVWLPHZLQB-UHFFFAOYSA-N
MW264.12 g/mol
LogP3.94
Rot. Bonds2

About 2-(4-bromophenoxy)-5-methylpyridine

2-(4-bromophenoxy)-5-methylpyridine (PubChem CID 24700025) has the molecular formula C12H10BrNO and a molecular weight of 264.12 g/mol. Its IUPAC name is 2-(4-bromophenoxy)-5-methylpyridine.

Molecular Properties

Compound Name2-(4-bromophenoxy)-5-methylpyridine
PubChem CID24700025
Molecular FormulaC12H10BrNO
Molecular Weight264.12 g/mol
Exact Mass262.99
IUPAC Name2-(4-bromophenoxy)-5-methylpyridine
SMILESCc1ccc(Oc2ccc(Br)cc2)nc1
InChIInChI=1S/C12H10BrNO/c1-9-2-7-12(14-8-9)15-11-5-3-10(13)4-6-11/h2-8H,1H3
InChIKeyRZXUVVWLPHZLQB-UHFFFAOYSA-N
XLogP3.94
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.12
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(4-bromophenoxy)-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

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenoxy)-5-methylpyridine?
The IUPAC name of 2-(4-bromophenoxy)-5-methylpyridine (CID 24700025) is 2-(4-bromophenoxy)-5-methylpyridine.
What is the SMILES notation for 2-(4-bromophenoxy)-5-methylpyridine?
The canonical SMILES for 2-(4-bromophenoxy)-5-methylpyridine is Cc1ccc(Oc2ccc(Br)cc2)nc1.
What is the InChIKey of 2-(4-bromophenoxy)-5-methylpyridine?
The InChIKey is RZXUVVWLPHZLQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrNO/c1-9-2-7-12(14-8-9)15-11-5-3-10(13)4-6-11/h2-8H,1H3.
What are the key properties of 2-(4-bromophenoxy)-5-methylpyridine?
2-(4-bromophenoxy)-5-methylpyridine has a molecular weight of 264.12 g/mol, XLogP of 3.94, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenoxy)-5-methylpyridine is sourced from PubChem (CID 24700025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).