2-[(2-amino-2-oxoethyl)-(dimethylsulfamoyl)amino]acetic acid

C6H13N3O5S — CID 107435768

IUPAC2-[(2-amino-2-oxoethyl)-(dimethylsulfamoyl)amino]acetic acid
SMILESCN(C)S(=O)(=O)N(CC(N)=O)CC(=O)O
InChIInChI=1S/C6H13N3O5S/c1-8(2)15(13,14)9(3-5(7)10)4-6(11)12/h3-4H2,1-2H3,(H2,7,10)(H,11,12)
InChIKeyFOSXBNBTMHYXTA-UHFFFAOYSA-N
MW239.25 g/mol
LogP-2.34
Rot. Bonds6

About 2-[(2-amino-2-oxoethyl)-(dimethylsulfamoyl)amino]acetic acid

2-[(2-amino-2-oxoethyl)-(dimethylsulfamoyl)amino]acetic acid (PubChem CID 107435768) has the molecular formula C6H13N3O5S and a molecular weight of 239.25 g/mol. Its IUPAC name is 2-[(2-amino-2-oxoethyl)-(dimethylsulfamoyl)amino]acetic acid.

Molecular Properties

Compound Name2-[(2-amino-2-oxoethyl)-(dimethylsulfamoyl)amino]acetic acid
PubChem CID107435768
Molecular FormulaC6H13N3O5S
Molecular Weight239.25 g/mol
Exact Mass239.06
IUPAC Name2-[(2-amino-2-oxoethyl)-(dimethylsulfamoyl)amino]acetic acid
SMILESCN(C)S(=O)(=O)N(CC(N)=O)CC(=O)O
InChIInChI=1S/C6H13N3O5S/c1-8(2)15(13,14)9(3-5(7)10)4-6(11)12/h3-4H2,1-2H3,(H2,7,10)(H,11,12)
InChIKeyFOSXBNBTMHYXTA-UHFFFAOYSA-N
XLogP-2.34
TPSA121.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.25
LogP ≤ 5-2.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[(2-amino-2-oxoethyl)-(dimethylsulfamoyl)amino]acetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[dimethylsulfamoyl(methyl)amino]acetamide
CID 82076047
2-[dimethylsulfamoyl(2,2,2-trifluoroethyl)amino]acetic acid
CID 79258153
2-[carboxymethyl-[methyl(propan-2-yl)sulfamoyl]amino]acetic acid
CID 55245356
2-[(2-amino-2-oxoethyl)-butylsulfonylamino]acetic acid
CID 107435665
2-[carboxymethyl(diethylsulfamoyl)amino]acetic acid
CID 3615000
3-[(2-amino-2-oxoethyl)-ethylsulfamoyl]propanoic acid
CID 103101578
2-[(2-amino-2-oxoethyl)-(2,4,6-trimethylphenyl)sulfonylamino]acetic acid
CID 107435837
2-[carboxymethyl(ethylsulfonyl)amino]acetic acid
CID 23524492
2-[(2-amino-2-oxoethyl)-(4-methoxy-4-oxobutyl)sulfonylamino]acetic acid
CID 107435713
2-[(2-amino-2-oxoethyl)-(2-methylpropyl)sulfamoyl]acetic acid
CID 60952335
2-[methyl(sulfamoyl)amino]acetamide
CID 112686000
2-[(2-amino-2-oxoethyl)-[(E)-2-phenylethenyl]sulfonylamino]acetic acid
CID 107435617

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-2-oxoethyl)-(dimethylsulfamoyl)amino]acetic acid?
The IUPAC name of 2-[(2-amino-2-oxoethyl)-(dimethylsulfamoyl)amino]acetic acid (CID 107435768) is 2-[(2-amino-2-oxoethyl)-(dimethylsulfamoyl)amino]acetic acid.
What is the SMILES notation for 2-[(2-amino-2-oxoethyl)-(dimethylsulfamoyl)amino]acetic acid?
The canonical SMILES for 2-[(2-amino-2-oxoethyl)-(dimethylsulfamoyl)amino]acetic acid is CN(C)S(=O)(=O)N(CC(N)=O)CC(=O)O.
What is the InChIKey of 2-[(2-amino-2-oxoethyl)-(dimethylsulfamoyl)amino]acetic acid?
The InChIKey is FOSXBNBTMHYXTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3O5S/c1-8(2)15(13,14)9(3-5(7)10)4-6(11)12/h3-4H2,1-2H3,(H2,7,10)(H,11,12).
What are the key properties of 2-[(2-amino-2-oxoethyl)-(dimethylsulfamoyl)amino]acetic acid?
2-[(2-amino-2-oxoethyl)-(dimethylsulfamoyl)amino]acetic acid has a molecular weight of 239.25 g/mol, XLogP of -2.34, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-2-oxoethyl)-(dimethylsulfamoyl)amino]acetic acid is sourced from PubChem (CID 107435768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).