6-N-ethyl-2-N-methyl-2-N-(2-methylsulfonylethyl)pyrazine-2,6-diamine

C10H18N4O2S — CID 78924800

IUPAC6-N-ethyl-2-N-methyl-2-N-(2-methylsulfonylethyl)pyrazine-2,6-diamine
SMILESCCNc1cncc(N(C)CCS(C)(=O)=O)n1
InChIInChI=1S/C10H18N4O2S/c1-4-12-9-7-11-8-10(13-9)14(2)5-6-17(3,15)16/h7-8H,4-6H2,1-3H3,(H,12,13)
InChIKeyLRDPWLMTVIUKAM-UHFFFAOYSA-N
MW258.35 g/mol
LogP0.39
Rot. Bonds6

About 6-N-ethyl-2-N-methyl-2-N-(2-methylsulfonylethyl)pyrazine-2,6-diamine

6-N-ethyl-2-N-methyl-2-N-(2-methylsulfonylethyl)pyrazine-2,6-diamine (PubChem CID 78924800) has the molecular formula C10H18N4O2S and a molecular weight of 258.35 g/mol. Its IUPAC name is 6-N-ethyl-2-N-methyl-2-N-(2-methylsulfonylethyl)pyrazine-2,6-diamine.

Molecular Properties

Compound Name6-N-ethyl-2-N-methyl-2-N-(2-methylsulfonylethyl)pyrazine-2,6-diamine
PubChem CID78924800
Molecular FormulaC10H18N4O2S
Molecular Weight258.35 g/mol
Exact Mass258.12
IUPAC Name6-N-ethyl-2-N-methyl-2-N-(2-methylsulfonylethyl)pyrazine-2,6-diamine
SMILESCCNc1cncc(N(C)CCS(C)(=O)=O)n1
InChIInChI=1S/C10H18N4O2S/c1-4-12-9-7-11-8-10(13-9)14(2)5-6-17(3,15)16/h7-8H,4-6H2,1-3H3,(H,12,13)
InChIKeyLRDPWLMTVIUKAM-UHFFFAOYSA-N
XLogP0.39
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.35
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-N-ethyl-2-N-methyl-2-N-(2-methylsulfonylethyl)pyrazine-2,6-diamine?
The IUPAC name of 6-N-ethyl-2-N-methyl-2-N-(2-methylsulfonylethyl)pyrazine-2,6-diamine (CID 78924800) is 6-N-ethyl-2-N-methyl-2-N-(2-methylsulfonylethyl)pyrazine-2,6-diamine.
What is the SMILES notation for 6-N-ethyl-2-N-methyl-2-N-(2-methylsulfonylethyl)pyrazine-2,6-diamine?
The canonical SMILES for 6-N-ethyl-2-N-methyl-2-N-(2-methylsulfonylethyl)pyrazine-2,6-diamine is CCNc1cncc(N(C)CCS(C)(=O)=O)n1.
What is the InChIKey of 6-N-ethyl-2-N-methyl-2-N-(2-methylsulfonylethyl)pyrazine-2,6-diamine?
The InChIKey is LRDPWLMTVIUKAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2S/c1-4-12-9-7-11-8-10(13-9)14(2)5-6-17(3,15)16/h7-8H,4-6H2,1-3H3,(H,12,13).
What are the key properties of 6-N-ethyl-2-N-methyl-2-N-(2-methylsulfonylethyl)pyrazine-2,6-diamine?
6-N-ethyl-2-N-methyl-2-N-(2-methylsulfonylethyl)pyrazine-2,6-diamine has a molecular weight of 258.35 g/mol, XLogP of 0.39, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-ethyl-2-N-methyl-2-N-(2-methylsulfonylethyl)pyrazine-2,6-diamine is sourced from PubChem (CID 78924800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).