N-ethyl-2-oxo-2-phenylethanesulfonamide

C10H13NO3S — CID 135086608

IUPACN-ethyl-2-oxo-2-phenylethanesulfonamide
SMILESCCNS(=O)(=O)CC(=O)c1ccccc1
InChIInChI=1S/C10H13NO3S/c1-2-11-15(13,14)8-10(12)9-6-4-3-5-7-9/h3-7,11H,2,8H2,1H3
InChIKeyZRZBSWSYYKRWIA-UHFFFAOYSA-N
MW227.28 g/mol
LogP0.81
Rot. Bonds5

About N-ethyl-2-oxo-2-phenylethanesulfonamide

N-ethyl-2-oxo-2-phenylethanesulfonamide (PubChem CID 135086608) has the molecular formula C10H13NO3S and a molecular weight of 227.28 g/mol. Its IUPAC name is N-ethyl-2-oxo-2-phenylethanesulfonamide.

Molecular Properties

Compound NameN-ethyl-2-oxo-2-phenylethanesulfonamide
PubChem CID135086608
Molecular FormulaC10H13NO3S
Molecular Weight227.28 g/mol
Exact Mass227.06
IUPAC NameN-ethyl-2-oxo-2-phenylethanesulfonamide
SMILESCCNS(=O)(=O)CC(=O)c1ccccc1
InChIInChI=1S/C10H13NO3S/c1-2-11-15(13,14)8-10(12)9-6-4-3-5-7-9/h3-7,11H,2,8H2,1H3
InChIKeyZRZBSWSYYKRWIA-UHFFFAOYSA-N
XLogP0.81
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.28
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-oxo-2-phenylethanesulfonamide?
The IUPAC name of N-ethyl-2-oxo-2-phenylethanesulfonamide (CID 135086608) is N-ethyl-2-oxo-2-phenylethanesulfonamide.
What is the SMILES notation for N-ethyl-2-oxo-2-phenylethanesulfonamide?
The canonical SMILES for N-ethyl-2-oxo-2-phenylethanesulfonamide is CCNS(=O)(=O)CC(=O)c1ccccc1.
What is the InChIKey of N-ethyl-2-oxo-2-phenylethanesulfonamide?
The InChIKey is ZRZBSWSYYKRWIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO3S/c1-2-11-15(13,14)8-10(12)9-6-4-3-5-7-9/h3-7,11H,2,8H2,1H3.
What are the key properties of N-ethyl-2-oxo-2-phenylethanesulfonamide?
N-ethyl-2-oxo-2-phenylethanesulfonamide has a molecular weight of 227.28 g/mol, XLogP of 0.81, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-oxo-2-phenylethanesulfonamide is sourced from PubChem (CID 135086608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).