3-bromo-5-chloro-2-(3-methylphenoxy)pyridine

C12H9BrClNO — CID 114837538

IUPAC3-bromo-5-chloro-2-(3-methylphenoxy)pyridine
SMILESCc1cccc(Oc2ncc(Cl)cc2Br)c1
InChIInChI=1S/C12H9BrClNO/c1-8-3-2-4-10(5-8)16-12-11(13)6-9(14)7-15-12/h2-7H,1H3
InChIKeyLQQDPOSLHHDQOQ-UHFFFAOYSA-N
MW298.57 g/mol
LogP4.60
Rot. Bonds2

About 3-bromo-5-chloro-2-(3-methylphenoxy)pyridine

3-bromo-5-chloro-2-(3-methylphenoxy)pyridine (PubChem CID 114837538) has the molecular formula C12H9BrClNO and a molecular weight of 298.57 g/mol. Its IUPAC name is 3-bromo-5-chloro-2-(3-methylphenoxy)pyridine.

Molecular Properties

Compound Name3-bromo-5-chloro-2-(3-methylphenoxy)pyridine
PubChem CID114837538
Molecular FormulaC12H9BrClNO
Molecular Weight298.57 g/mol
Exact Mass296.96
IUPAC Name3-bromo-5-chloro-2-(3-methylphenoxy)pyridine
SMILESCc1cccc(Oc2ncc(Cl)cc2Br)c1
InChIInChI=1S/C12H9BrClNO/c1-8-3-2-4-10(5-8)16-12-11(13)6-9(14)7-15-12/h2-7H,1H3
InChIKeyLQQDPOSLHHDQOQ-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 3-bromo-5-chloro-2-(3-methylphenoxy)pyridine 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-[(3-bromo-5-chloro-2-pyridinyl)oxy]benzamide
CID 114837598
3-bromo-5-chloro-2-(3-nitrophenoxy)pyridine
CID 114837695
3-bromo-5-chloro-2-(4-chloro-2-methylphenoxy)pyridine
CID 114837551
7-[(3-bromo-5-chloro-2-pyridinyl)oxy]quinoline
CID 107314450
3-bromo-2-(4-chloro-3-methylphenoxy)-5-methylpyridine
CID 105368164
8-[(3-bromo-5-chloro-2-pyridinyl)oxy]quinoline
CID 114837621
3-bromo-2-(2-bromo-4-chlorophenoxy)-5-methylpyridine
CID 105368214
3-bromo-2-(4-tert-butyl-2-methylphenoxy)-5-chloropyridine
CID 114837638
5-chloro-4-(3-methylphenoxy)pyrimidin-2-amine
CID 80869678
3,5-dichloro-2-(3-chlorophenoxy)pyridine
CID 91013057
3-bromo-2-(3,4-difluorophenoxy)-5-methylpyridine
CID 105368266
1-chloro-3-(3-methylphenoxy)benzene;ethane
CID 153343625

Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-chloro-2-(3-methylphenoxy)pyridine?
The IUPAC name of 3-bromo-5-chloro-2-(3-methylphenoxy)pyridine (CID 114837538) is 3-bromo-5-chloro-2-(3-methylphenoxy)pyridine.
What is the SMILES notation for 3-bromo-5-chloro-2-(3-methylphenoxy)pyridine?
The canonical SMILES for 3-bromo-5-chloro-2-(3-methylphenoxy)pyridine is Cc1cccc(Oc2ncc(Cl)cc2Br)c1.
What is the InChIKey of 3-bromo-5-chloro-2-(3-methylphenoxy)pyridine?
The InChIKey is LQQDPOSLHHDQOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9BrClNO/c1-8-3-2-4-10(5-8)16-12-11(13)6-9(14)7-15-12/h2-7H,1H3.
What are the key properties of 3-bromo-5-chloro-2-(3-methylphenoxy)pyridine?
3-bromo-5-chloro-2-(3-methylphenoxy)pyridine 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 3-bromo-5-chloro-2-(3-methylphenoxy)pyridine is sourced from PubChem (CID 114837538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).