2-(5-methoxypyrazin-2-yl)ethanesulfonamide

C7H11N3O3S — CID 145191179

IUPAC2-(5-methoxypyrazin-2-yl)ethanesulfonamide
SMILESCOc1cnc(CCS(N)(=O)=O)cn1
InChIInChI=1S/C7H11N3O3S/c1-13-7-5-9-6(4-10-7)2-3-14(8,11)12/h4-5H,2-3H2,1H3,(H2,8,11,12)
InChIKeyGWBUIPLPFVVYEC-UHFFFAOYSA-N
MW217.25 g/mol
LogP-0.68
Rot. Bonds4

About 2-(5-methoxypyrazin-2-yl)ethanesulfonamide

2-(5-methoxypyrazin-2-yl)ethanesulfonamide (PubChem CID 145191179) has the molecular formula C7H11N3O3S and a molecular weight of 217.25 g/mol. Its IUPAC name is 2-(5-methoxypyrazin-2-yl)ethanesulfonamide.

Molecular Properties

Compound Name2-(5-methoxypyrazin-2-yl)ethanesulfonamide
PubChem CID145191179
Molecular FormulaC7H11N3O3S
Molecular Weight217.25 g/mol
Exact Mass217.05
IUPAC Name2-(5-methoxypyrazin-2-yl)ethanesulfonamide
SMILESCOc1cnc(CCS(N)(=O)=O)cn1
InChIInChI=1S/C7H11N3O3S/c1-13-7-5-9-6(4-10-7)2-3-14(8,11)12/h4-5H,2-3H2,1H3,(H2,8,11,12)
InChIKeyGWBUIPLPFVVYEC-UHFFFAOYSA-N
XLogP-0.68
TPSA95.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.25
LogP ≤ 5-0.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methoxypyrazin-2-yl)ethanesulfonamide?
The IUPAC name of 2-(5-methoxypyrazin-2-yl)ethanesulfonamide (CID 145191179) is 2-(5-methoxypyrazin-2-yl)ethanesulfonamide.
What is the SMILES notation for 2-(5-methoxypyrazin-2-yl)ethanesulfonamide?
The canonical SMILES for 2-(5-methoxypyrazin-2-yl)ethanesulfonamide is COc1cnc(CCS(N)(=O)=O)cn1.
What is the InChIKey of 2-(5-methoxypyrazin-2-yl)ethanesulfonamide?
The InChIKey is GWBUIPLPFVVYEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O3S/c1-13-7-5-9-6(4-10-7)2-3-14(8,11)12/h4-5H,2-3H2,1H3,(H2,8,11,12).
What are the key properties of 2-(5-methoxypyrazin-2-yl)ethanesulfonamide?
2-(5-methoxypyrazin-2-yl)ethanesulfonamide has a molecular weight of 217.25 g/mol, XLogP of -0.68, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methoxypyrazin-2-yl)ethanesulfonamide is sourced from PubChem (CID 145191179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).