2-[(6-aminopyrazin-2-yl)amino]-N-methylethanesulfonamide

C7H13N5O2S — CID 106343062

IUPAC2-[(6-aminopyrazin-2-yl)amino]-N-methylethanesulfonamide
SMILESCNS(=O)(=O)CCNc1cncc(N)n1
InChIInChI=1S/C7H13N5O2S/c1-9-15(13,14)3-2-11-7-5-10-4-6(8)12-7/h4-5,9H,2-3H2,1H3,(H3,8,11,12)
InChIKeyJXDNAQMBFLGQBC-UHFFFAOYSA-N
MW231.28 g/mol
LogP-0.98
Rot. Bonds5

About 2-[(6-aminopyrazin-2-yl)amino]-N-methylethanesulfonamide

2-[(6-aminopyrazin-2-yl)amino]-N-methylethanesulfonamide (PubChem CID 106343062) has the molecular formula C7H13N5O2S and a molecular weight of 231.28 g/mol. Its IUPAC name is 2-[(6-aminopyrazin-2-yl)amino]-N-methylethanesulfonamide.

Molecular Properties

Compound Name2-[(6-aminopyrazin-2-yl)amino]-N-methylethanesulfonamide
PubChem CID106343062
Molecular FormulaC7H13N5O2S
Molecular Weight231.28 g/mol
Exact Mass231.08
IUPAC Name2-[(6-aminopyrazin-2-yl)amino]-N-methylethanesulfonamide
SMILESCNS(=O)(=O)CCNc1cncc(N)n1
InChIInChI=1S/C7H13N5O2S/c1-9-15(13,14)3-2-11-7-5-10-4-6(8)12-7/h4-5,9H,2-3H2,1H3,(H3,8,11,12)
InChIKeyJXDNAQMBFLGQBC-UHFFFAOYSA-N
XLogP-0.98
TPSA110.00 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.28
LogP ≤ 5-0.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

2-[(6-amino-2-pyridinyl)amino]-N-methylethanesulfonamide
CID 106343060
methyl 6-[2-(methylsulfamoyl)ethylamino]pyrazine-2-carboxylate
CID 114175311
N-[2-[(6-aminopyrazin-2-yl)amino]ethyl]methanesulfonamide
CID 78988761
N-methyl-2-(pyrazin-2-ylamino)ethanesulfonamide
CID 106337907
2-N-ethylpyrazine-2,6-diamine
CID 69290778
2-[(6-amino-2-cyclopropylpyrimidin-4-yl)amino]-N-methylethanesulfonamide
CID 114176051
2-[(6-amino-2-propylpyrimidin-4-yl)amino]-N-methylethanesulfonamide
CID 106343133
2-N-(3,3-dimethylbutyl)pyrazine-2,6-diamine
CID 115599185
N-[1-[(6-aminopyrazin-2-yl)amino]-2-methylpropan-2-yl]methanesulfonamide
CID 78953806
2-[(5-amino-3-methyl-2-pyridinyl)amino]-N-methylethanesulfonamide
CID 106333992
2-[(2-chloro-6-methylpyrimidin-4-yl)amino]-N-methylethanesulfonamide
CID 106341549
2-[[2-tert-butyl-6-(methylamino)pyrimidin-4-yl]amino]-N-methylethanesulfonamide
CID 106343155

Frequently Asked Questions

What is the IUPAC name of 2-[(6-aminopyrazin-2-yl)amino]-N-methylethanesulfonamide?
The IUPAC name of 2-[(6-aminopyrazin-2-yl)amino]-N-methylethanesulfonamide (CID 106343062) is 2-[(6-aminopyrazin-2-yl)amino]-N-methylethanesulfonamide.
What is the SMILES notation for 2-[(6-aminopyrazin-2-yl)amino]-N-methylethanesulfonamide?
The canonical SMILES for 2-[(6-aminopyrazin-2-yl)amino]-N-methylethanesulfonamide is CNS(=O)(=O)CCNc1cncc(N)n1.
What is the InChIKey of 2-[(6-aminopyrazin-2-yl)amino]-N-methylethanesulfonamide?
The InChIKey is JXDNAQMBFLGQBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N5O2S/c1-9-15(13,14)3-2-11-7-5-10-4-6(8)12-7/h4-5,9H,2-3H2,1H3,(H3,8,11,12).
What are the key properties of 2-[(6-aminopyrazin-2-yl)amino]-N-methylethanesulfonamide?
2-[(6-aminopyrazin-2-yl)amino]-N-methylethanesulfonamide has a molecular weight of 231.28 g/mol, XLogP of -0.98, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-aminopyrazin-2-yl)amino]-N-methylethanesulfonamide is sourced from PubChem (CID 106343062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).