2-hydroxyethanesulfonamide

C2H7NO3S — CID 20504590

IUPAC2-hydroxyethanesulfonamide
SMILESNS(=O)(=O)CCO
InChIInChI=1S/C2H7NO3S/c3-7(5,6)2-1-4/h4H,1-2H2,(H2,3,5,6)
InChIKeyBLGJHQMNSBYLEZ-UHFFFAOYSA-N
MW125.15 g/mol
LogP-1.73
Rot. Bonds2

About 2-hydroxyethanesulfonamide

2-hydroxyethanesulfonamide (PubChem CID 20504590) has the molecular formula C2H7NO3S and a molecular weight of 125.15 g/mol. Its IUPAC name is 2-hydroxyethanesulfonamide.

Molecular Properties

Compound Name2-hydroxyethanesulfonamide
PubChem CID20504590
Molecular FormulaC2H7NO3S
Molecular Weight125.15 g/mol
Exact Mass125.01
IUPAC Name2-hydroxyethanesulfonamide
SMILESNS(=O)(=O)CCO
InChIInChI=1S/C2H7NO3S/c3-7(5,6)2-1-4/h4H,1-2H2,(H2,3,5,6)
InChIKeyBLGJHQMNSBYLEZ-UHFFFAOYSA-N
XLogP-1.73
TPSA80.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.15
LogP ≤ 5-1.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Isethionate
CID 3955599
2-Hydroxyethane-1-sulfonyl chloride
CID 13138998
Ethanesulfonic acid, 2-hydroxy-, ammonium salt (1:1)
CID 93602
3-Hydroxypropane-1-sulfonamide
CID 10486918
1-Hydroxypropane-2-sulfonamide
CID 65744038
2-Hydroxyethane-1-sulfinamide
CID 89072268
(2S)-1-hydroxypropane-2-sulfonamide
CID 165980565
Isethionic acid ammonium salt
CID 14007809
Sulfonamidoethanol
CID 21520684
(r)-(Hydroxyethyl)sulfonamide
CID 87665442
1-Fluoro-2-hydroxyethane-1-sulfonamide
CID 167272265
CID 5359625
CID 5359625

Frequently Asked Questions

What is the IUPAC name of 2-hydroxyethanesulfonamide?
The IUPAC name of 2-hydroxyethanesulfonamide (CID 20504590) is 2-hydroxyethanesulfonamide.
What is the SMILES notation for 2-hydroxyethanesulfonamide?
The canonical SMILES for 2-hydroxyethanesulfonamide is NS(=O)(=O)CCO.
What is the InChIKey of 2-hydroxyethanesulfonamide?
The InChIKey is BLGJHQMNSBYLEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7NO3S/c3-7(5,6)2-1-4/h4H,1-2H2,(H2,3,5,6).
What are the key properties of 2-hydroxyethanesulfonamide?
2-hydroxyethanesulfonamide has a molecular weight of 125.15 g/mol, XLogP of -1.73, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyethanesulfonamide is sourced from PubChem (CID 20504590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).