2-(methylamino)ethanesulfonamide;hydrochloride

C3H11ClN2O2S — CID 126806011

IUPAC2-(methylamino)ethanesulfonamide;hydrochloride
SMILESCNCCS(N)(=O)=O.Cl
InChIInChI=1S/C3H10N2O2S.ClH/c1-5-2-3-8(4,6)7;/h5H,2-3H2,1H3,(H2,4,6,7);1H
InChIKeyMYXMVULJZGHTFP-UHFFFAOYSA-N
MW174.65 g/mol
LogP-1.08
Rot. Bonds3

About 2-(methylamino)ethanesulfonamide;hydrochloride

2-(methylamino)ethanesulfonamide;hydrochloride (PubChem CID 126806011) has the molecular formula C3H11ClN2O2S and a molecular weight of 174.65 g/mol. Its IUPAC name is 2-(methylamino)ethanesulfonamide;hydrochloride.

Molecular Properties

Compound Name2-(methylamino)ethanesulfonamide;hydrochloride
PubChem CID126806011
Molecular FormulaC3H11ClN2O2S
Molecular Weight174.65 g/mol
Exact Mass174.02
IUPAC Name2-(methylamino)ethanesulfonamide;hydrochloride
SMILESCNCCS(N)(=O)=O.Cl
InChIInChI=1S/C3H10N2O2S.ClH/c1-5-2-3-8(4,6)7;/h5H,2-3H2,1H3,(H2,4,6,7);1H
InChIKeyMYXMVULJZGHTFP-UHFFFAOYSA-N
XLogP-1.08
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.65
LogP ≤ 5-1.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)ethanesulfonamide;hydrochloride?
The IUPAC name of 2-(methylamino)ethanesulfonamide;hydrochloride (CID 126806011) is 2-(methylamino)ethanesulfonamide;hydrochloride.
What is the SMILES notation for 2-(methylamino)ethanesulfonamide;hydrochloride?
The canonical SMILES for 2-(methylamino)ethanesulfonamide;hydrochloride is CNCCS(N)(=O)=O.Cl.
What is the InChIKey of 2-(methylamino)ethanesulfonamide;hydrochloride?
The InChIKey is MYXMVULJZGHTFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H10N2O2S.ClH/c1-5-2-3-8(4,6)7;/h5H,2-3H2,1H3,(H2,4,6,7);1H.
What are the key properties of 2-(methylamino)ethanesulfonamide;hydrochloride?
2-(methylamino)ethanesulfonamide;hydrochloride has a molecular weight of 174.65 g/mol, XLogP of -1.08, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)ethanesulfonamide;hydrochloride is sourced from PubChem (CID 126806011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).