2-[[2-(methanesulfonamido)acetyl]amino]acetic acid

C5H10N2O5S — CID 43386638

IUPAC2-[[2-(methanesulfonamido)acetyl]amino]acetic acid
SMILESCS(=O)(=O)NCC(=O)NCC(=O)O
InChIInChI=1S/C5H10N2O5S/c1-13(11,12)7-2-4(8)6-3-5(9)10/h7H,2-3H2,1H3,(H,6,8)(H,9,10)
InChIKeyDQIIOIDXQIQSIQ-UHFFFAOYSA-N
MW210.21 g/mol
LogP-2.26
Rot. Bonds5

About 2-[[2-(methanesulfonamido)acetyl]amino]acetic acid

2-[[2-(methanesulfonamido)acetyl]amino]acetic acid (PubChem CID 43386638) has the molecular formula C5H10N2O5S and a molecular weight of 210.21 g/mol. Its IUPAC name is 2-[[2-(methanesulfonamido)acetyl]amino]acetic acid.

Molecular Properties

Compound Name2-[[2-(methanesulfonamido)acetyl]amino]acetic acid
PubChem CID43386638
Molecular FormulaC5H10N2O5S
Molecular Weight210.21 g/mol
Exact Mass210.03
IUPAC Name2-[[2-(methanesulfonamido)acetyl]amino]acetic acid
SMILESCS(=O)(=O)NCC(=O)NCC(=O)O
InChIInChI=1S/C5H10N2O5S/c1-13(11,12)7-2-4(8)6-3-5(9)10/h7H,2-3H2,1H3,(H,6,8)(H,9,10)
InChIKeyDQIIOIDXQIQSIQ-UHFFFAOYSA-N
XLogP-2.26
TPSA112.57 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.21
LogP ≤ 5-2.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-[[2-(methanesulfonamido)acetyl]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

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(methanesulfonamido)acetyl]amino]acetic acid?
The IUPAC name of 2-[[2-(methanesulfonamido)acetyl]amino]acetic acid (CID 43386638) is 2-[[2-(methanesulfonamido)acetyl]amino]acetic acid.
What is the SMILES notation for 2-[[2-(methanesulfonamido)acetyl]amino]acetic acid?
The canonical SMILES for 2-[[2-(methanesulfonamido)acetyl]amino]acetic acid is CS(=O)(=O)NCC(=O)NCC(=O)O.
What is the InChIKey of 2-[[2-(methanesulfonamido)acetyl]amino]acetic acid?
The InChIKey is DQIIOIDXQIQSIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O5S/c1-13(11,12)7-2-4(8)6-3-5(9)10/h7H,2-3H2,1H3,(H,6,8)(H,9,10).
What are the key properties of 2-[[2-(methanesulfonamido)acetyl]amino]acetic acid?
2-[[2-(methanesulfonamido)acetyl]amino]acetic acid has a molecular weight of 210.21 g/mol, XLogP of -2.26, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(methanesulfonamido)acetyl]amino]acetic acid is sourced from PubChem (CID 43386638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).