N-[2-(2-hydroxyethoxy)ethyl]ethanesulfonamide

C6H15NO4S — CID 62498131

IUPACN-[2-(2-hydroxyethoxy)ethyl]ethanesulfonamide
SMILESCCS(=O)(=O)NCCOCCO
InChIInChI=1S/C6H15NO4S/c1-2-12(9,10)7-3-5-11-6-4-8/h7-8H,2-6H2,1H3
InChIKeyUQLXYIBPPYKYLF-UHFFFAOYSA-N
MW197.26 g/mol
LogP-1.07
Rot. Bonds7

About N-[2-(2-hydroxyethoxy)ethyl]ethanesulfonamide

N-[2-(2-hydroxyethoxy)ethyl]ethanesulfonamide (PubChem CID 62498131) has the molecular formula C6H15NO4S and a molecular weight of 197.26 g/mol. Its IUPAC name is N-[2-(2-hydroxyethoxy)ethyl]ethanesulfonamide.

Molecular Properties

Compound NameN-[2-(2-hydroxyethoxy)ethyl]ethanesulfonamide
PubChem CID62498131
Molecular FormulaC6H15NO4S
Molecular Weight197.26 g/mol
Exact Mass197.07
IUPAC NameN-[2-(2-hydroxyethoxy)ethyl]ethanesulfonamide
SMILESCCS(=O)(=O)NCCOCCO
InChIInChI=1S/C6H15NO4S/c1-2-12(9,10)7-3-5-11-6-4-8/h7-8H,2-6H2,1H3
InChIKeyUQLXYIBPPYKYLF-UHFFFAOYSA-N
XLogP-1.07
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.26
LogP ≤ 5-1.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-hydroxyethoxy)ethyl]ethanesulfonamide?
The IUPAC name of N-[2-(2-hydroxyethoxy)ethyl]ethanesulfonamide (CID 62498131) is N-[2-(2-hydroxyethoxy)ethyl]ethanesulfonamide.
What is the SMILES notation for N-[2-(2-hydroxyethoxy)ethyl]ethanesulfonamide?
The canonical SMILES for N-[2-(2-hydroxyethoxy)ethyl]ethanesulfonamide is CCS(=O)(=O)NCCOCCO.
What is the InChIKey of N-[2-(2-hydroxyethoxy)ethyl]ethanesulfonamide?
The InChIKey is UQLXYIBPPYKYLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO4S/c1-2-12(9,10)7-3-5-11-6-4-8/h7-8H,2-6H2,1H3.
What are the key properties of N-[2-(2-hydroxyethoxy)ethyl]ethanesulfonamide?
N-[2-(2-hydroxyethoxy)ethyl]ethanesulfonamide has a molecular weight of 197.26 g/mol, XLogP of -1.07, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-hydroxyethoxy)ethyl]ethanesulfonamide is sourced from PubChem (CID 62498131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).