N-methyl-6-(4-methylsulfanylphenoxy)pyridin-2-amine

C13H14N2OS — CID 80879367

IUPACN-methyl-6-(4-methylsulfanylphenoxy)pyridin-2-amine
SMILESCNc1cccc(Oc2ccc(SC)cc2)n1
InChIInChI=1S/C13H14N2OS/c1-14-12-4-3-5-13(15-12)16-10-6-8-11(17-2)9-7-10/h3-9H,1-2H3,(H,14,15)
InChIKeyVRIJLAJXYMTXDR-UHFFFAOYSA-N
MW246.33 g/mol
LogP3.64
Rot. Bonds4

About N-methyl-6-(4-methylsulfanylphenoxy)pyridin-2-amine

N-methyl-6-(4-methylsulfanylphenoxy)pyridin-2-amine (PubChem CID 80879367) has the molecular formula C13H14N2OS and a molecular weight of 246.33 g/mol. Its IUPAC name is N-methyl-6-(4-methylsulfanylphenoxy)pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-6-(4-methylsulfanylphenoxy)pyridin-2-amine
PubChem CID80879367
Molecular FormulaC13H14N2OS
Molecular Weight246.33 g/mol
Exact Mass246.08
IUPAC NameN-methyl-6-(4-methylsulfanylphenoxy)pyridin-2-amine
SMILESCNc1cccc(Oc2ccc(SC)cc2)n1
InChIInChI=1S/C13H14N2OS/c1-14-12-4-3-5-13(15-12)16-10-6-8-11(17-2)9-7-10/h3-9H,1-2H3,(H,14,15)
InChIKeyVRIJLAJXYMTXDR-UHFFFAOYSA-N
XLogP3.64
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.33
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-6-phenoxypyridin-2-amine
CID 58106895
2-methyl-6-(4-methylsulfanylphenoxy)pyridine
CID 123742413
N-methyl-1-[6-(4-methylsulfanylphenoxy)-2-pyridinyl]methanamine
CID 55244628
6-(4-methoxyphenyl)sulfanyl-N-methylpyridin-2-amine
CID 80883462
2-chloro-4-(4-methylsulfanylphenoxy)pyrimidine
CID 60726000
6-[3-(methoxymethyl)phenoxy]-N-methylpyridin-2-amine
CID 80876349
N-methyl-6-methylsulfanylpyridin-2-amine
CID 59956274
6-[(4-methoxyphenyl)methoxy]-N-methylpyridin-2-amine
CID 80865107
6-(2,4-dimethylphenoxy)-N-methylpyridin-2-amine
CID 80863130
[6-(4-iodophenoxy)-2-pyridinyl]hydrazine
CID 80916365
2-fluoro-6-[[6-(methylamino)-2-pyridinyl]oxy]benzonitrile
CID 80873989
N-tert-butyl-6-(4-ethoxyphenoxy)pyridin-2-amine
CID 115498695

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-(4-methylsulfanylphenoxy)pyridin-2-amine?
The IUPAC name of N-methyl-6-(4-methylsulfanylphenoxy)pyridin-2-amine (CID 80879367) is N-methyl-6-(4-methylsulfanylphenoxy)pyridin-2-amine.
What is the SMILES notation for N-methyl-6-(4-methylsulfanylphenoxy)pyridin-2-amine?
The canonical SMILES for N-methyl-6-(4-methylsulfanylphenoxy)pyridin-2-amine is CNc1cccc(Oc2ccc(SC)cc2)n1.
What is the InChIKey of N-methyl-6-(4-methylsulfanylphenoxy)pyridin-2-amine?
The InChIKey is VRIJLAJXYMTXDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2OS/c1-14-12-4-3-5-13(15-12)16-10-6-8-11(17-2)9-7-10/h3-9H,1-2H3,(H,14,15).
What are the key properties of N-methyl-6-(4-methylsulfanylphenoxy)pyridin-2-amine?
N-methyl-6-(4-methylsulfanylphenoxy)pyridin-2-amine has a molecular weight of 246.33 g/mol, XLogP of 3.64, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-(4-methylsulfanylphenoxy)pyridin-2-amine is sourced from PubChem (CID 80879367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).