2-methyl-6-(4-methylsulfanylphenoxy)pyridine

C13H13NOS — CID 123742413

IUPAC2-methyl-6-(4-methylsulfanylphenoxy)pyridine
SMILESCSc1ccc(Oc2cccc(C)n2)cc1
InChIInChI=1S/C13H13NOS/c1-10-4-3-5-13(14-10)15-11-6-8-12(16-2)9-7-11/h3-9H,1-2H3
InChIKeyVHQXUQRUKIGPOH-UHFFFAOYSA-N
MW231.32 g/mol
LogP3.90
Rot. Bonds3

About 2-methyl-6-(4-methylsulfanylphenoxy)pyridine

2-methyl-6-(4-methylsulfanylphenoxy)pyridine (PubChem CID 123742413) has the molecular formula C13H13NOS and a molecular weight of 231.32 g/mol. Its IUPAC name is 2-methyl-6-(4-methylsulfanylphenoxy)pyridine.

Molecular Properties

Compound Name2-methyl-6-(4-methylsulfanylphenoxy)pyridine
PubChem CID123742413
Molecular FormulaC13H13NOS
Molecular Weight231.32 g/mol
Exact Mass231.07
IUPAC Name2-methyl-6-(4-methylsulfanylphenoxy)pyridine
SMILESCSc1ccc(Oc2cccc(C)n2)cc1
InChIInChI=1S/C13H13NOS/c1-10-4-3-5-13(14-10)15-11-6-8-12(16-2)9-7-11/h3-9H,1-2H3
InChIKeyVHQXUQRUKIGPOH-UHFFFAOYSA-N
XLogP3.90
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.32
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-6-(4-methylsulfanylphenoxy)pyridin-2-amine
CID 80879367
2-(4-chlorophenoxy)-6-methylpyridine;ethane
CID 168898019
N-methyl-1-[6-(4-methylsulfanylphenoxy)-2-pyridinyl]methanamine
CID 55244628
2-chloro-4-(4-methylsulfanylphenoxy)pyrimidine
CID 60726000
CID 155722884
CID 155722884
2-(3-iodophenoxy)-6-methylpyridine
CID 61400141
2-chloro-4-[(6-methyl-2-pyridinyl)oxy]aniline
CID 62113791
2-methyl-6-[3-[(6-methyl-2-pyridinyl)oxy]-5-pyridin-2-yloxyphenoxy]pyridine
CID 146608885
[2-chloro-4-[(6-methyl-2-pyridinyl)oxy]phenyl]methanamine
CID 102724765
6-methyl-2-(4-methylsulfanylphenoxy)pyridine-3-carbonitrile
CID 63648336
2-(4-methylsulfanylphenoxy)pyridin-4-amine
CID 63649308
1-fluoro-3-(4-methylsulfanylphenoxy)benzene
CID 138722497

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(4-methylsulfanylphenoxy)pyridine?
The IUPAC name of 2-methyl-6-(4-methylsulfanylphenoxy)pyridine (CID 123742413) is 2-methyl-6-(4-methylsulfanylphenoxy)pyridine.
What is the SMILES notation for 2-methyl-6-(4-methylsulfanylphenoxy)pyridine?
The canonical SMILES for 2-methyl-6-(4-methylsulfanylphenoxy)pyridine is CSc1ccc(Oc2cccc(C)n2)cc1.
What is the InChIKey of 2-methyl-6-(4-methylsulfanylphenoxy)pyridine?
The InChIKey is VHQXUQRUKIGPOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NOS/c1-10-4-3-5-13(14-10)15-11-6-8-12(16-2)9-7-11/h3-9H,1-2H3.
What are the key properties of 2-methyl-6-(4-methylsulfanylphenoxy)pyridine?
2-methyl-6-(4-methylsulfanylphenoxy)pyridine has a molecular weight of 231.32 g/mol, XLogP of 3.90, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(4-methylsulfanylphenoxy)pyridine is sourced from PubChem (CID 123742413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).