6-methoxy-2-(2-methylsulfanylphenoxy)pyridin-3-amine

C13H14N2O2S — CID 115321147

IUPAC6-methoxy-2-(2-methylsulfanylphenoxy)pyridin-3-amine
SMILESCOc1ccc(N)c(Oc2ccccc2SC)n1
InChIInChI=1S/C13H14N2O2S/c1-16-12-8-7-9(14)13(15-12)17-10-5-3-4-6-11(10)18-2/h3-8H,14H2,1-2H3
InChIKeyMAFKZMWWSKHYCB-UHFFFAOYSA-N
MW262.33 g/mol
LogP3.19
Rot. Bonds4

About 6-methoxy-2-(2-methylsulfanylphenoxy)pyridin-3-amine

6-methoxy-2-(2-methylsulfanylphenoxy)pyridin-3-amine (PubChem CID 115321147) has the molecular formula C13H14N2O2S and a molecular weight of 262.33 g/mol. Its IUPAC name is 6-methoxy-2-(2-methylsulfanylphenoxy)pyridin-3-amine.

Molecular Properties

Compound Name6-methoxy-2-(2-methylsulfanylphenoxy)pyridin-3-amine
PubChem CID115321147
Molecular FormulaC13H14N2O2S
Molecular Weight262.33 g/mol
Exact Mass262.08
IUPAC Name6-methoxy-2-(2-methylsulfanylphenoxy)pyridin-3-amine
SMILESCOc1ccc(N)c(Oc2ccccc2SC)n1
InChIInChI=1S/C13H14N2O2S/c1-16-12-8-7-9(14)13(15-12)17-10-5-3-4-6-11(10)18-2/h3-8H,14H2,1-2H3
InChIKeyMAFKZMWWSKHYCB-UHFFFAOYSA-N
XLogP3.19
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-(2-methylsulfanylphenoxy)pyridin-3-amine?
The IUPAC name of 6-methoxy-2-(2-methylsulfanylphenoxy)pyridin-3-amine (CID 115321147) is 6-methoxy-2-(2-methylsulfanylphenoxy)pyridin-3-amine.
What is the SMILES notation for 6-methoxy-2-(2-methylsulfanylphenoxy)pyridin-3-amine?
The canonical SMILES for 6-methoxy-2-(2-methylsulfanylphenoxy)pyridin-3-amine is COc1ccc(N)c(Oc2ccccc2SC)n1.
What is the InChIKey of 6-methoxy-2-(2-methylsulfanylphenoxy)pyridin-3-amine?
The InChIKey is MAFKZMWWSKHYCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2S/c1-16-12-8-7-9(14)13(15-12)17-10-5-3-4-6-11(10)18-2/h3-8H,14H2,1-2H3.
What are the key properties of 6-methoxy-2-(2-methylsulfanylphenoxy)pyridin-3-amine?
6-methoxy-2-(2-methylsulfanylphenoxy)pyridin-3-amine has a molecular weight of 262.33 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-(2-methylsulfanylphenoxy)pyridin-3-amine is sourced from PubChem (CID 115321147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).