4-methylsulfanylpyridin-3-amine

C6H8N2S — CID 15656137

IUPAC4-methylsulfanylpyridin-3-amine
SMILESCSc1ccncc1N
InChIInChI=1S/C6H8N2S/c1-9-6-2-3-8-4-5(6)7/h2-4H,7H2,1H3
InChIKeyIMJRXBSOKCHICY-UHFFFAOYSA-N
MW140.21 g/mol
LogP1.39
Rot. Bonds1

About 4-methylsulfanylpyridin-3-amine

4-methylsulfanylpyridin-3-amine (PubChem CID 15656137) has the molecular formula C6H8N2S and a molecular weight of 140.21 g/mol. Its IUPAC name is 4-methylsulfanylpyridin-3-amine.

Molecular Properties

Compound Name4-methylsulfanylpyridin-3-amine
PubChem CID15656137
Molecular FormulaC6H8N2S
Molecular Weight140.21 g/mol
Exact Mass140.04
IUPAC Name4-methylsulfanylpyridin-3-amine
SMILESCSc1ccncc1N
InChIInChI=1S/C6H8N2S/c1-9-6-2-3-8-4-5(6)7/h2-4H,7H2,1H3
InChIKeyIMJRXBSOKCHICY-UHFFFAOYSA-N
XLogP1.39
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.21
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methylsulfanylpyridin-3-amine?
The IUPAC name of 4-methylsulfanylpyridin-3-amine (CID 15656137) is 4-methylsulfanylpyridin-3-amine.
What is the SMILES notation for 4-methylsulfanylpyridin-3-amine?
The canonical SMILES for 4-methylsulfanylpyridin-3-amine is CSc1ccncc1N.
What is the InChIKey of 4-methylsulfanylpyridin-3-amine?
The InChIKey is IMJRXBSOKCHICY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2S/c1-9-6-2-3-8-4-5(6)7/h2-4H,7H2,1H3.
What are the key properties of 4-methylsulfanylpyridin-3-amine?
4-methylsulfanylpyridin-3-amine has a molecular weight of 140.21 g/mol, XLogP of 1.39, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylsulfanylpyridin-3-amine is sourced from PubChem (CID 15656137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).