5-methyl-2-methylsulfanylpyrimidin-4-amine

C6H9N3S — CID 593218

IUPAC5-methyl-2-methylsulfanylpyrimidin-4-amine
SMILESCSc1ncc(C)c(N)n1
InChIInChI=1S/C6H9N3S/c1-4-3-8-6(10-2)9-5(4)7/h3H,1-2H3,(H2,7,8,9)
InChIKeyGSAVMWCLXXJBLU-UHFFFAOYSA-N
MW155.23 g/mol
LogP1.09
Rot. Bonds1

About 5-methyl-2-methylsulfanylpyrimidin-4-amine

5-methyl-2-methylsulfanylpyrimidin-4-amine (PubChem CID 593218) has the molecular formula C6H9N3S and a molecular weight of 155.23 g/mol. Its IUPAC name is 5-methyl-2-methylsulfanylpyrimidin-4-amine.

Molecular Properties

Compound Name5-methyl-2-methylsulfanylpyrimidin-4-amine
PubChem CID593218
Molecular FormulaC6H9N3S
Molecular Weight155.23 g/mol
Exact Mass155.05
IUPAC Name5-methyl-2-methylsulfanylpyrimidin-4-amine
SMILESCSc1ncc(C)c(N)n1
InChIInChI=1S/C6H9N3S/c1-4-3-8-6(10-2)9-5(4)7/h3H,1-2H3,(H2,7,8,9)
InChIKeyGSAVMWCLXXJBLU-UHFFFAOYSA-N
XLogP1.09
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.23
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-methylsulfanylpyrimidin-4-amine?
The IUPAC name of 5-methyl-2-methylsulfanylpyrimidin-4-amine (CID 593218) is 5-methyl-2-methylsulfanylpyrimidin-4-amine.
What is the SMILES notation for 5-methyl-2-methylsulfanylpyrimidin-4-amine?
The canonical SMILES for 5-methyl-2-methylsulfanylpyrimidin-4-amine is CSc1ncc(C)c(N)n1.
What is the InChIKey of 5-methyl-2-methylsulfanylpyrimidin-4-amine?
The InChIKey is GSAVMWCLXXJBLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3S/c1-4-3-8-6(10-2)9-5(4)7/h3H,1-2H3,(H2,7,8,9).
What are the key properties of 5-methyl-2-methylsulfanylpyrimidin-4-amine?
5-methyl-2-methylsulfanylpyrimidin-4-amine has a molecular weight of 155.23 g/mol, XLogP of 1.09, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-methylsulfanylpyrimidin-4-amine is sourced from PubChem (CID 593218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).