2-[cyclopropyl(methyl)sulfamoyl]acetic acid

C6H11NO4S — CID 43264853

IUPAC2-[cyclopropyl(methyl)sulfamoyl]acetic acid
SMILESCN(C1CC1)S(=O)(=O)CC(=O)O
InChIInChI=1S/C6H11NO4S/c1-7(5-2-3-5)12(10,11)4-6(8)9/h5H,2-4H2,1H3,(H,8,9)
InChIKeyJGIMPRPDMIYGIW-UHFFFAOYSA-N
MW193.22 g/mol
LogP-0.50
Rot. Bonds4

About 2-[cyclopropyl(methyl)sulfamoyl]acetic acid

2-[cyclopropyl(methyl)sulfamoyl]acetic acid (PubChem CID 43264853) has the molecular formula C6H11NO4S and a molecular weight of 193.22 g/mol. Its IUPAC name is 2-[cyclopropyl(methyl)sulfamoyl]acetic acid.

Molecular Properties

Compound Name2-[cyclopropyl(methyl)sulfamoyl]acetic acid
PubChem CID43264853
Molecular FormulaC6H11NO4S
Molecular Weight193.22 g/mol
Exact Mass193.04
IUPAC Name2-[cyclopropyl(methyl)sulfamoyl]acetic acid
SMILESCN(C1CC1)S(=O)(=O)CC(=O)O
InChIInChI=1S/C6H11NO4S/c1-7(5-2-3-5)12(10,11)4-6(8)9/h5H,2-4H2,1H3,(H,8,9)
InChIKeyJGIMPRPDMIYGIW-UHFFFAOYSA-N
XLogP-0.50
TPSA74.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.22
LogP ≤ 5-0.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl(methyl)sulfamoyl]acetic acid?
The IUPAC name of 2-[cyclopropyl(methyl)sulfamoyl]acetic acid (CID 43264853) is 2-[cyclopropyl(methyl)sulfamoyl]acetic acid.
What is the SMILES notation for 2-[cyclopropyl(methyl)sulfamoyl]acetic acid?
The canonical SMILES for 2-[cyclopropyl(methyl)sulfamoyl]acetic acid is CN(C1CC1)S(=O)(=O)CC(=O)O.
What is the InChIKey of 2-[cyclopropyl(methyl)sulfamoyl]acetic acid?
The InChIKey is JGIMPRPDMIYGIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO4S/c1-7(5-2-3-5)12(10,11)4-6(8)9/h5H,2-4H2,1H3,(H,8,9).
What are the key properties of 2-[cyclopropyl(methyl)sulfamoyl]acetic acid?
2-[cyclopropyl(methyl)sulfamoyl]acetic acid has a molecular weight of 193.22 g/mol, XLogP of -0.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl(methyl)sulfamoyl]acetic acid is sourced from PubChem (CID 43264853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).