(2R)-2-methyl-3-sulfamoylpropanoic acid

C4H9NO4S — CID 18738435

IUPAC(2R)-2-methyl-3-sulfamoylpropanoic acid
SMILESC[C@@H](CS(N)(=O)=O)C(=O)O
InChIInChI=1S/C4H9NO4S/c1-3(4(6)7)2-10(5,8)9/h3H,2H2,1H3,(H,6,7)(H2,5,8,9)/t3-/m0/s1
InChIKeyBRDMDISAYVJSAR-VKHMYHEASA-N
MW167.19 g/mol
LogP-1.00
Rot. Bonds3

About (2R)-2-methyl-3-sulfamoylpropanoic acid

(2R)-2-methyl-3-sulfamoylpropanoic acid (PubChem CID 18738435) has the molecular formula C4H9NO4S and a molecular weight of 167.19 g/mol. Its IUPAC name is (2R)-2-methyl-3-sulfamoylpropanoic acid.

Molecular Properties

Compound Name(2R)-2-methyl-3-sulfamoylpropanoic acid
PubChem CID18738435
Molecular FormulaC4H9NO4S
Molecular Weight167.19 g/mol
Exact Mass167.03
IUPAC Name(2R)-2-methyl-3-sulfamoylpropanoic acid
SMILESC[C@@H](CS(N)(=O)=O)C(=O)O
InChIInChI=1S/C4H9NO4S/c1-3(4(6)7)2-10(5,8)9/h3H,2H2,1H3,(H,6,7)(H2,5,8,9)/t3-/m0/s1
InChIKeyBRDMDISAYVJSAR-VKHMYHEASA-N
XLogP-1.00
TPSA97.46 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.19
LogP ≤ 5-1.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-sulfamoylbutanoic Acid
CID 2773320
2-Sulfamoylpropanoic acid
CID 19833533
3-Sulfamoylpropanoic acid
CID 21718767
3-(Methylsulfamoyl)propanoic acid
CID 14148292
3-Methanesulfonyl-2-methylpropanoic acid
CID 22142344
2-Methyl-3-sulfinopropanoic acid
CID 2828757
3-(Fluorosulfonyl)-2-methylpropanoic acid
CID 167722623
CID 23205167
CID 23205167
3-Hydroxy-2-methyl-3-oxopropane-1-sulfinate
CID 3805367
Propanoic acid, 2-methyl-3-(methylsulfonyl)-, (S)-
CID 15814191
3-((dimethylamino)sulfonyl]-2(R)-methylpropionic acid
CID 18738436
2-Sulfamoylbutanoic acid
CID 21241990

Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-3-sulfamoylpropanoic acid?
The IUPAC name of (2R)-2-methyl-3-sulfamoylpropanoic acid (CID 18738435) is (2R)-2-methyl-3-sulfamoylpropanoic acid.
What is the SMILES notation for (2R)-2-methyl-3-sulfamoylpropanoic acid?
The canonical SMILES for (2R)-2-methyl-3-sulfamoylpropanoic acid is C[C@@H](CS(N)(=O)=O)C(=O)O.
What is the InChIKey of (2R)-2-methyl-3-sulfamoylpropanoic acid?
The InChIKey is BRDMDISAYVJSAR-VKHMYHEASA-N. The full InChI is InChI=1S/C4H9NO4S/c1-3(4(6)7)2-10(5,8)9/h3H,2H2,1H3,(H,6,7)(H2,5,8,9)/t3-/m0/s1.
What are the key properties of (2R)-2-methyl-3-sulfamoylpropanoic acid?
(2R)-2-methyl-3-sulfamoylpropanoic acid has a molecular weight of 167.19 g/mol, XLogP of -1.00, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-3-sulfamoylpropanoic acid is sourced from PubChem (CID 18738435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).