2-[(2-amino-2-oxoethyl)-(2-methylpropyl)sulfamoyl]acetic acid

C8H16N2O5S — CID 60952335

IUPAC2-[(2-amino-2-oxoethyl)-(2-methylpropyl)sulfamoyl]acetic acid
SMILESCC(C)CN(CC(N)=O)S(=O)(=O)CC(=O)O
InChIInChI=1S/C8H16N2O5S/c1-6(2)3-10(4-7(9)11)16(14,15)5-8(12)13/h6H,3-5H2,1-2H3,(H2,9,11)(H,12,13)
InChIKeyXPDRDUOKXAODEX-UHFFFAOYSA-N
MW252.29 g/mol
LogP-1.16
Rot. Bonds7

About 2-[(2-amino-2-oxoethyl)-(2-methylpropyl)sulfamoyl]acetic acid

2-[(2-amino-2-oxoethyl)-(2-methylpropyl)sulfamoyl]acetic acid (PubChem CID 60952335) has the molecular formula C8H16N2O5S and a molecular weight of 252.29 g/mol. Its IUPAC name is 2-[(2-amino-2-oxoethyl)-(2-methylpropyl)sulfamoyl]acetic acid.

Molecular Properties

Compound Name2-[(2-amino-2-oxoethyl)-(2-methylpropyl)sulfamoyl]acetic acid
PubChem CID60952335
Molecular FormulaC8H16N2O5S
Molecular Weight252.29 g/mol
Exact Mass252.08
IUPAC Name2-[(2-amino-2-oxoethyl)-(2-methylpropyl)sulfamoyl]acetic acid
SMILESCC(C)CN(CC(N)=O)S(=O)(=O)CC(=O)O
InChIInChI=1S/C8H16N2O5S/c1-6(2)3-10(4-7(9)11)16(14,15)5-8(12)13/h6H,3-5H2,1-2H3,(H2,9,11)(H,12,13)
InChIKeyXPDRDUOKXAODEX-UHFFFAOYSA-N
XLogP-1.16
TPSA117.77 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.29
LogP ≤ 5-1.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[(2-amino-2-oxoethyl)-(2-methylpropyl)sulfamoyl]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-[bis(3-methylbutyl)sulfamoyl]acetic acid
CID 60950660
2-[(2-ethoxy-2-oxoethyl)sulfonyl-(2-methylpropyl)amino]acetic acid
CID 63064138
2-[3-methylbutylsulfonyl(2-methylpropyl)amino]acetic acid
CID 63856773
2-[(2-aminophenyl)methylsulfonyl-(2-methylpropyl)amino]acetamide
CID 62020901
2-[2-methylpropyl(prop-2-enylsulfonyl)amino]acetic acid
CID 79673279
2-[(2-amino-2-oxoethyl)-[bis(2-methylpropyl)carbamoyl]amino]acetic acid
CID 107438124
3-[(2-amino-2-oxoethyl)-ethylsulfamoyl]propanoic acid
CID 103101578
2-[(2-amino-2-oxoethyl)-ethylsulfamoyl]propanoic acid
CID 103101618
2-[(2-amino-2-oxoethyl)-(dimethylsulfamoyl)amino]acetic acid
CID 107435768
2-[carboxymethyl(3-methylbutylsulfonyl)amino]acetic acid
CID 63858018
2-[[(2-amino-2-oxoethyl)-(2-methylpropyl)carbamoyl]-methylamino]acetic acid
CID 55003671
2-[(2-amino-2-oxoethyl)-butylsulfonylamino]acetic acid
CID 107435665

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-2-oxoethyl)-(2-methylpropyl)sulfamoyl]acetic acid?
The IUPAC name of 2-[(2-amino-2-oxoethyl)-(2-methylpropyl)sulfamoyl]acetic acid (CID 60952335) is 2-[(2-amino-2-oxoethyl)-(2-methylpropyl)sulfamoyl]acetic acid.
What is the SMILES notation for 2-[(2-amino-2-oxoethyl)-(2-methylpropyl)sulfamoyl]acetic acid?
The canonical SMILES for 2-[(2-amino-2-oxoethyl)-(2-methylpropyl)sulfamoyl]acetic acid is CC(C)CN(CC(N)=O)S(=O)(=O)CC(=O)O.
What is the InChIKey of 2-[(2-amino-2-oxoethyl)-(2-methylpropyl)sulfamoyl]acetic acid?
The InChIKey is XPDRDUOKXAODEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O5S/c1-6(2)3-10(4-7(9)11)16(14,15)5-8(12)13/h6H,3-5H2,1-2H3,(H2,9,11)(H,12,13).
What are the key properties of 2-[(2-amino-2-oxoethyl)-(2-methylpropyl)sulfamoyl]acetic acid?
2-[(2-amino-2-oxoethyl)-(2-methylpropyl)sulfamoyl]acetic acid has a molecular weight of 252.29 g/mol, XLogP of -1.16, 7 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)-(2-methylpropyl)sulfamoyl]acetic acid is sourced from PubChem (CID 60952335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).