N-methyl-6-(1-methylsulfonylpiperidin-4-yl)pyrazin-2-amine

C11H18N4O2S — CID 73439423

IUPACN-methyl-6-(1-methylsulfonylpiperidin-4-yl)pyrazin-2-amine
SMILESCNc1cncc(C2CCN(S(C)(=O)=O)CC2)n1
InChIInChI=1S/C11H18N4O2S/c1-12-11-8-13-7-10(14-11)9-3-5-15(6-4-9)18(2,16)17/h7-9H,3-6H2,1-2H3,(H,12,14)
InChIKeyZDITYKMNCPTZIL-UHFFFAOYSA-N
MW270.36 g/mol
LogP0.66
Rot. Bonds3

About N-methyl-6-(1-methylsulfonylpiperidin-4-yl)pyrazin-2-amine

N-methyl-6-(1-methylsulfonylpiperidin-4-yl)pyrazin-2-amine (PubChem CID 73439423) has the molecular formula C11H18N4O2S and a molecular weight of 270.36 g/mol. Its IUPAC name is N-methyl-6-(1-methylsulfonylpiperidin-4-yl)pyrazin-2-amine.

Molecular Properties

Compound NameN-methyl-6-(1-methylsulfonylpiperidin-4-yl)pyrazin-2-amine
PubChem CID73439423
Molecular FormulaC11H18N4O2S
Molecular Weight270.36 g/mol
Exact Mass270.12
IUPAC NameN-methyl-6-(1-methylsulfonylpiperidin-4-yl)pyrazin-2-amine
SMILESCNc1cncc(C2CCN(S(C)(=O)=O)CC2)n1
InChIInChI=1S/C11H18N4O2S/c1-12-11-8-13-7-10(14-11)9-3-5-15(6-4-9)18(2,16)17/h7-9H,3-6H2,1-2H3,(H,12,14)
InChIKeyZDITYKMNCPTZIL-UHFFFAOYSA-N
XLogP0.66
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.36
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-(1-methylsulfonylpiperidin-4-yl)pyrazin-2-amine?
The IUPAC name of N-methyl-6-(1-methylsulfonylpiperidin-4-yl)pyrazin-2-amine (CID 73439423) is N-methyl-6-(1-methylsulfonylpiperidin-4-yl)pyrazin-2-amine.
What is the SMILES notation for N-methyl-6-(1-methylsulfonylpiperidin-4-yl)pyrazin-2-amine?
The canonical SMILES for N-methyl-6-(1-methylsulfonylpiperidin-4-yl)pyrazin-2-amine is CNc1cncc(C2CCN(S(C)(=O)=O)CC2)n1.
What is the InChIKey of N-methyl-6-(1-methylsulfonylpiperidin-4-yl)pyrazin-2-amine?
The InChIKey is ZDITYKMNCPTZIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2S/c1-12-11-8-13-7-10(14-11)9-3-5-15(6-4-9)18(2,16)17/h7-9H,3-6H2,1-2H3,(H,12,14).
What are the key properties of N-methyl-6-(1-methylsulfonylpiperidin-4-yl)pyrazin-2-amine?
N-methyl-6-(1-methylsulfonylpiperidin-4-yl)pyrazin-2-amine has a molecular weight of 270.36 g/mol, XLogP of 0.66, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-(1-methylsulfonylpiperidin-4-yl)pyrazin-2-amine is sourced from PubChem (CID 73439423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).