N-methyl-6-(5-methylpyrimidin-2-yl)sulfanylpyrazin-2-amine

C10H11N5S — CID 80892411

IUPACN-methyl-6-(5-methylpyrimidin-2-yl)sulfanylpyrazin-2-amine
SMILESCNc1cncc(Sc2ncc(C)cn2)n1
InChIInChI=1S/C10H11N5S/c1-7-3-13-10(14-4-7)16-9-6-12-5-8(11-2)15-9/h3-6H,1-2H3,(H,11,15)
InChIKeyCRAAXUQNMPMXEU-UHFFFAOYSA-N
MW233.30 g/mol
LogP1.77
Rot. Bonds3

About N-methyl-6-(5-methylpyrimidin-2-yl)sulfanylpyrazin-2-amine

N-methyl-6-(5-methylpyrimidin-2-yl)sulfanylpyrazin-2-amine (PubChem CID 80892411) has the molecular formula C10H11N5S and a molecular weight of 233.30 g/mol. Its IUPAC name is N-methyl-6-(5-methylpyrimidin-2-yl)sulfanylpyrazin-2-amine.

Molecular Properties

Compound NameN-methyl-6-(5-methylpyrimidin-2-yl)sulfanylpyrazin-2-amine
PubChem CID80892411
Molecular FormulaC10H11N5S
Molecular Weight233.30 g/mol
Exact Mass233.07
IUPAC NameN-methyl-6-(5-methylpyrimidin-2-yl)sulfanylpyrazin-2-amine
SMILESCNc1cncc(Sc2ncc(C)cn2)n1
InChIInChI=1S/C10H11N5S/c1-7-3-13-10(14-4-7)16-9-6-12-5-8(11-2)15-9/h3-6H,1-2H3,(H,11,15)
InChIKeyCRAAXUQNMPMXEU-UHFFFAOYSA-N
XLogP1.77
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.30
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-(5-methylpyrimidin-2-yl)sulfanylpyrazin-2-amine?
The IUPAC name of N-methyl-6-(5-methylpyrimidin-2-yl)sulfanylpyrazin-2-amine (CID 80892411) is N-methyl-6-(5-methylpyrimidin-2-yl)sulfanylpyrazin-2-amine.
What is the SMILES notation for N-methyl-6-(5-methylpyrimidin-2-yl)sulfanylpyrazin-2-amine?
The canonical SMILES for N-methyl-6-(5-methylpyrimidin-2-yl)sulfanylpyrazin-2-amine is CNc1cncc(Sc2ncc(C)cn2)n1.
What is the InChIKey of N-methyl-6-(5-methylpyrimidin-2-yl)sulfanylpyrazin-2-amine?
The InChIKey is CRAAXUQNMPMXEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5S/c1-7-3-13-10(14-4-7)16-9-6-12-5-8(11-2)15-9/h3-6H,1-2H3,(H,11,15).
What are the key properties of N-methyl-6-(5-methylpyrimidin-2-yl)sulfanylpyrazin-2-amine?
N-methyl-6-(5-methylpyrimidin-2-yl)sulfanylpyrazin-2-amine has a molecular weight of 233.30 g/mol, XLogP of 1.77, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-(5-methylpyrimidin-2-yl)sulfanylpyrazin-2-amine is sourced from PubChem (CID 80892411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).