6-methylsulfinylpyridin-3-amine

C6H8N2OS — CID 22714585

IUPAC6-methylsulfinylpyridin-3-amine
SMILESCS(=O)c1ccc(N)cn1
InChIInChI=1S/C6H8N2OS/c1-10(9)6-3-2-5(7)4-8-6/h2-4H,7H2,1H3
InChIKeyAJMCTJYRFZZAFK-UHFFFAOYSA-N
MW156.21 g/mol
LogP0.40
Rot. Bonds1

About 6-methylsulfinylpyridin-3-amine

6-methylsulfinylpyridin-3-amine (PubChem CID 22714585) has the molecular formula C6H8N2OS and a molecular weight of 156.21 g/mol. Its IUPAC name is 6-methylsulfinylpyridin-3-amine.

Molecular Properties

Compound Name6-methylsulfinylpyridin-3-amine
PubChem CID22714585
Molecular FormulaC6H8N2OS
Molecular Weight156.21 g/mol
Exact Mass156.04
IUPAC Name6-methylsulfinylpyridin-3-amine
SMILESCS(=O)c1ccc(N)cn1
InChIInChI=1S/C6H8N2OS/c1-10(9)6-3-2-5(7)4-8-6/h2-4H,7H2,1H3
InChIKeyAJMCTJYRFZZAFK-UHFFFAOYSA-N
XLogP0.40
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.21
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methylsulfinylpyridin-3-amine?
The IUPAC name of 6-methylsulfinylpyridin-3-amine (CID 22714585) is 6-methylsulfinylpyridin-3-amine.
What is the SMILES notation for 6-methylsulfinylpyridin-3-amine?
The canonical SMILES for 6-methylsulfinylpyridin-3-amine is CS(=O)c1ccc(N)cn1.
What is the InChIKey of 6-methylsulfinylpyridin-3-amine?
The InChIKey is AJMCTJYRFZZAFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2OS/c1-10(9)6-3-2-5(7)4-8-6/h2-4H,7H2,1H3.
What are the key properties of 6-methylsulfinylpyridin-3-amine?
6-methylsulfinylpyridin-3-amine has a molecular weight of 156.21 g/mol, XLogP of 0.40, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylsulfinylpyridin-3-amine is sourced from PubChem (CID 22714585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).