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

C13H12ClNO2 — CID 141112024

IUPAC5-chloro-2-(3-methoxy-5-methylphenoxy)pyridine
SMILESCOc1cc(C)cc(Oc2ccc(Cl)cn2)c1
InChIInChI=1S/C13H12ClNO2/c1-9-5-11(16-2)7-12(6-9)17-13-4-3-10(14)8-15-13/h3-8H,1-2H3
InChIKeyZIFPUKRPBCDSGV-UHFFFAOYSA-N
MW249.70 g/mol
LogP3.84
Rot. Bonds3

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

5-chloro-2-(3-methoxy-5-methylphenoxy)pyridine (PubChem CID 141112024) has the molecular formula C13H12ClNO2 and a molecular weight of 249.70 g/mol. Its IUPAC name is 5-chloro-2-(3-methoxy-5-methylphenoxy)pyridine.

Molecular Properties

Compound Name5-chloro-2-(3-methoxy-5-methylphenoxy)pyridine
PubChem CID141112024
Molecular FormulaC13H12ClNO2
Molecular Weight249.70 g/mol
Exact Mass249.06
IUPAC Name5-chloro-2-(3-methoxy-5-methylphenoxy)pyridine
SMILESCOc1cc(C)cc(Oc2ccc(Cl)cn2)c1
InChIInChI=1S/C13H12ClNO2/c1-9-5-11(16-2)7-12(6-9)17-13-4-3-10(14)8-15-13/h3-8H,1-2H3
InChIKeyZIFPUKRPBCDSGV-UHFFFAOYSA-N
XLogP3.84
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.70
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(5-chloro-2-pyridinyl)oxy]-5-methoxybenzonitrile
CID 103568115
6-(3,5-dimethoxyphenoxy)pyridin-3-amine
CID 43589800
2-[(5-chloro-2-pyridinyl)oxy]-5-methoxyaniline
CID 43173743
2-(4-bromo-3-methylphenoxy)-5-chloropyridine
CID 83132873
5-(chloromethyl)-2-(3,5-dimethylphenoxy)pyridine
CID 61270098
2-(3-bromo-4-fluorophenoxy)-5-chloropyridine
CID 83233863
5-chloro-2-(4-propan-2-ylphenoxy)pyridine
CID 66234556
5-chloro-2-(2-methoxyphenoxy)pyridine
CID 66233202
5-chloro-2-(4-ethoxyphenoxy)pyridine
CID 66234109
6-(3,5-dimethoxyphenoxy)pyridine-3-carboxylic acid
CID 43589848
6-(3,5-dimethoxyphenoxy)pyridine-3-sulfonamide
CID 115928101
3-[(5-chloro-2-pyridinyl)oxy]aniline
CID 43364009

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(3-methoxy-5-methylphenoxy)pyridine?
The IUPAC name of 5-chloro-2-(3-methoxy-5-methylphenoxy)pyridine (CID 141112024) is 5-chloro-2-(3-methoxy-5-methylphenoxy)pyridine.
What is the SMILES notation for 5-chloro-2-(3-methoxy-5-methylphenoxy)pyridine?
The canonical SMILES for 5-chloro-2-(3-methoxy-5-methylphenoxy)pyridine is COc1cc(C)cc(Oc2ccc(Cl)cn2)c1.
What is the InChIKey of 5-chloro-2-(3-methoxy-5-methylphenoxy)pyridine?
The InChIKey is ZIFPUKRPBCDSGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClNO2/c1-9-5-11(16-2)7-12(6-9)17-13-4-3-10(14)8-15-13/h3-8H,1-2H3.
What are the key properties of 5-chloro-2-(3-methoxy-5-methylphenoxy)pyridine?
5-chloro-2-(3-methoxy-5-methylphenoxy)pyridine has a molecular weight of 249.70 g/mol, XLogP of 3.84, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(3-methoxy-5-methylphenoxy)pyridine is sourced from PubChem (CID 141112024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).