2-[2-(dimethylamino)ethylsulfamoyl]acetic acid

C6H14N2O4S — CID 28773458

IUPAC2-[2-(dimethylamino)ethylsulfamoyl]acetic acid
SMILESCN(C)CCNS(=O)(=O)CC(=O)O
InChIInChI=1S/C6H14N2O4S/c1-8(2)4-3-7-13(11,12)5-6(9)10/h7H,3-5H2,1-2H3,(H,9,10)
InChIKeyADDIRFFPZRENHV-UHFFFAOYSA-N
MW210.25 g/mol
LogP-1.45
Rot. Bonds6

About 2-[2-(dimethylamino)ethylsulfamoyl]acetic acid

2-[2-(dimethylamino)ethylsulfamoyl]acetic acid (PubChem CID 28773458) has the molecular formula C6H14N2O4S and a molecular weight of 210.25 g/mol. Its IUPAC name is 2-[2-(dimethylamino)ethylsulfamoyl]acetic acid.

Molecular Properties

Compound Name2-[2-(dimethylamino)ethylsulfamoyl]acetic acid
PubChem CID28773458
Molecular FormulaC6H14N2O4S
Molecular Weight210.25 g/mol
Exact Mass210.07
IUPAC Name2-[2-(dimethylamino)ethylsulfamoyl]acetic acid
SMILESCN(C)CCNS(=O)(=O)CC(=O)O
InChIInChI=1S/C6H14N2O4S/c1-8(2)4-3-7-13(11,12)5-6(9)10/h7H,3-5H2,1-2H3,(H,9,10)
InChIKeyADDIRFFPZRENHV-UHFFFAOYSA-N
XLogP-1.45
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 5-1.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)ethylsulfamoyl]acetic acid?
The IUPAC name of 2-[2-(dimethylamino)ethylsulfamoyl]acetic acid (CID 28773458) is 2-[2-(dimethylamino)ethylsulfamoyl]acetic acid.
What is the SMILES notation for 2-[2-(dimethylamino)ethylsulfamoyl]acetic acid?
The canonical SMILES for 2-[2-(dimethylamino)ethylsulfamoyl]acetic acid is CN(C)CCNS(=O)(=O)CC(=O)O.
What is the InChIKey of 2-[2-(dimethylamino)ethylsulfamoyl]acetic acid?
The InChIKey is ADDIRFFPZRENHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O4S/c1-8(2)4-3-7-13(11,12)5-6(9)10/h7H,3-5H2,1-2H3,(H,9,10).
What are the key properties of 2-[2-(dimethylamino)ethylsulfamoyl]acetic acid?
2-[2-(dimethylamino)ethylsulfamoyl]acetic acid has a molecular weight of 210.25 g/mol, XLogP of -1.45, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)ethylsulfamoyl]acetic acid is sourced from PubChem (CID 28773458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).