2-ethylsulfonylacetamide

C4H9NO3S — CID 19029221

IUPAC2-ethylsulfonylacetamide
SMILESCCS(=O)(=O)CC(N)=O
InChIInChI=1S/C4H9NO3S/c1-2-9(7,8)3-4(5)6/h2-3H2,1H3,(H2,5,6)
InChIKeyPVTYEZXVIDJKOU-UHFFFAOYSA-N
MW151.19 g/mol
LogP-1.09
Rot. Bonds3

About 2-ethylsulfonylacetamide

2-ethylsulfonylacetamide (PubChem CID 19029221) has the molecular formula C4H9NO3S and a molecular weight of 151.19 g/mol. Its IUPAC name is 2-ethylsulfonylacetamide.

Molecular Properties

Compound Name2-ethylsulfonylacetamide
PubChem CID19029221
Molecular FormulaC4H9NO3S
Molecular Weight151.19 g/mol
Exact Mass151.03
IUPAC Name2-ethylsulfonylacetamide
SMILESCCS(=O)(=O)CC(N)=O
InChIInChI=1S/C4H9NO3S/c1-2-9(7,8)3-4(5)6/h2-3H2,1H3,(H2,5,6)
InChIKeyPVTYEZXVIDJKOU-UHFFFAOYSA-N
XLogP-1.09
TPSA77.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.19
LogP ≤ 5-1.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethylsulfonylacetamide?
The IUPAC name of 2-ethylsulfonylacetamide (CID 19029221) is 2-ethylsulfonylacetamide.
What is the SMILES notation for 2-ethylsulfonylacetamide?
The canonical SMILES for 2-ethylsulfonylacetamide is CCS(=O)(=O)CC(N)=O.
What is the InChIKey of 2-ethylsulfonylacetamide?
The InChIKey is PVTYEZXVIDJKOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO3S/c1-2-9(7,8)3-4(5)6/h2-3H2,1H3,(H2,5,6).
What are the key properties of 2-ethylsulfonylacetamide?
2-ethylsulfonylacetamide has a molecular weight of 151.19 g/mol, XLogP of -1.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylsulfonylacetamide is sourced from PubChem (CID 19029221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).