2-methoxyethanesulfonamide

C3H9NO3S — CID 18951506

IUPAC2-methoxyethanesulfonamide
SMILESCOCCS(N)(=O)=O
InChIInChI=1S/C3H9NO3S/c1-7-2-3-8(4,5)6/h2-3H2,1H3,(H2,4,5,6)
InChIKeyCLPQSNXTFZZLHB-UHFFFAOYSA-N
MW139.18 g/mol
LogP-1.08
Rot. Bonds3

About 2-methoxyethanesulfonamide

2-methoxyethanesulfonamide (PubChem CID 18951506) has the molecular formula C3H9NO3S and a molecular weight of 139.18 g/mol. Its IUPAC name is 2-methoxyethanesulfonamide.

Molecular Properties

Compound Name2-methoxyethanesulfonamide
PubChem CID18951506
Molecular FormulaC3H9NO3S
Molecular Weight139.18 g/mol
Exact Mass139.03
IUPAC Name2-methoxyethanesulfonamide
SMILESCOCCS(N)(=O)=O
InChIInChI=1S/C3H9NO3S/c1-7-2-3-8(4,5)6/h2-3H2,1H3,(H2,4,5,6)
InChIKeyCLPQSNXTFZZLHB-UHFFFAOYSA-N
XLogP-1.08
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.18
LogP ≤ 5-1.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxyethanesulfonamide?
The IUPAC name of 2-methoxyethanesulfonamide (CID 18951506) is 2-methoxyethanesulfonamide.
What is the SMILES notation for 2-methoxyethanesulfonamide?
The canonical SMILES for 2-methoxyethanesulfonamide is COCCS(N)(=O)=O.
What is the InChIKey of 2-methoxyethanesulfonamide?
The InChIKey is CLPQSNXTFZZLHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9NO3S/c1-7-2-3-8(4,5)6/h2-3H2,1H3,(H2,4,5,6).
What are the key properties of 2-methoxyethanesulfonamide?
2-methoxyethanesulfonamide has a molecular weight of 139.18 g/mol, XLogP of -1.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxyethanesulfonamide is sourced from PubChem (CID 18951506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).