2-[(6-chloropyrazin-2-yl)amino]ethanesulfonamide

C6H9ClN4O2S — CID 10376849

IUPAC2-[(6-chloropyrazin-2-yl)amino]ethanesulfonamide
SMILESNS(=O)(=O)CCNc1cncc(Cl)n1
InChIInChI=1S/C6H9ClN4O2S/c7-5-3-9-4-6(11-5)10-1-2-14(8,12)13/h3-4H,1-2H2,(H,10,11)(H2,8,12,13)
InChIKeyZJSABCHUFXODTD-UHFFFAOYSA-N
MW236.68 g/mol
LogP-0.17
Rot. Bonds4

About 2-[(6-chloropyrazin-2-yl)amino]ethanesulfonamide

2-[(6-chloropyrazin-2-yl)amino]ethanesulfonamide (PubChem CID 10376849) has the molecular formula C6H9ClN4O2S and a molecular weight of 236.68 g/mol. Its IUPAC name is 2-[(6-chloropyrazin-2-yl)amino]ethanesulfonamide.

Molecular Properties

Compound Name2-[(6-chloropyrazin-2-yl)amino]ethanesulfonamide
PubChem CID10376849
Molecular FormulaC6H9ClN4O2S
Molecular Weight236.68 g/mol
Exact Mass236.01
IUPAC Name2-[(6-chloropyrazin-2-yl)amino]ethanesulfonamide
SMILESNS(=O)(=O)CCNc1cncc(Cl)n1
InChIInChI=1S/C6H9ClN4O2S/c7-5-3-9-4-6(11-5)10-1-2-14(8,12)13/h3-4H,1-2H2,(H,10,11)(H2,8,12,13)
InChIKeyZJSABCHUFXODTD-UHFFFAOYSA-N
XLogP-0.17
TPSA97.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.68
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(6-chloropyrazin-2-yl)amino]ethanesulfonamide?
The IUPAC name of 2-[(6-chloropyrazin-2-yl)amino]ethanesulfonamide (CID 10376849) is 2-[(6-chloropyrazin-2-yl)amino]ethanesulfonamide.
What is the SMILES notation for 2-[(6-chloropyrazin-2-yl)amino]ethanesulfonamide?
The canonical SMILES for 2-[(6-chloropyrazin-2-yl)amino]ethanesulfonamide is NS(=O)(=O)CCNc1cncc(Cl)n1.
What is the InChIKey of 2-[(6-chloropyrazin-2-yl)amino]ethanesulfonamide?
The InChIKey is ZJSABCHUFXODTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9ClN4O2S/c7-5-3-9-4-6(11-5)10-1-2-14(8,12)13/h3-4H,1-2H2,(H,10,11)(H2,8,12,13).
What are the key properties of 2-[(6-chloropyrazin-2-yl)amino]ethanesulfonamide?
2-[(6-chloropyrazin-2-yl)amino]ethanesulfonamide has a molecular weight of 236.68 g/mol, XLogP of -0.17, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-chloropyrazin-2-yl)amino]ethanesulfonamide is sourced from PubChem (CID 10376849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).