2-[cyclopropyl(propyl)sulfamoyl]acetic acid

C8H15NO4S — CID 43270267

IUPAC2-[cyclopropyl(propyl)sulfamoyl]acetic acid
SMILESCCCN(C1CC1)S(=O)(=O)CC(=O)O
InChIInChI=1S/C8H15NO4S/c1-2-5-9(7-3-4-7)14(12,13)6-8(10)11/h7H,2-6H2,1H3,(H,10,11)
InChIKeyPMWWYTILWHWIBR-UHFFFAOYSA-N
MW221.28 g/mol
LogP0.28
Rot. Bonds6

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

2-[cyclopropyl(propyl)sulfamoyl]acetic acid (PubChem CID 43270267) has the molecular formula C8H15NO4S and a molecular weight of 221.28 g/mol. Its IUPAC name is 2-[cyclopropyl(propyl)sulfamoyl]acetic acid.

Molecular Properties

Compound Name2-[cyclopropyl(propyl)sulfamoyl]acetic acid
PubChem CID43270267
Molecular FormulaC8H15NO4S
Molecular Weight221.28 g/mol
Exact Mass221.07
IUPAC Name2-[cyclopropyl(propyl)sulfamoyl]acetic acid
SMILESCCCN(C1CC1)S(=O)(=O)CC(=O)O
InChIInChI=1S/C8H15NO4S/c1-2-5-9(7-3-4-7)14(12,13)6-8(10)11/h7H,2-6H2,1H3,(H,10,11)
InChIKeyPMWWYTILWHWIBR-UHFFFAOYSA-N
XLogP0.28
TPSA74.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.28
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl(propyl)sulfamoyl]acetic acid?
The IUPAC name of 2-[cyclopropyl(propyl)sulfamoyl]acetic acid (CID 43270267) is 2-[cyclopropyl(propyl)sulfamoyl]acetic acid.
What is the SMILES notation for 2-[cyclopropyl(propyl)sulfamoyl]acetic acid?
The canonical SMILES for 2-[cyclopropyl(propyl)sulfamoyl]acetic acid is CCCN(C1CC1)S(=O)(=O)CC(=O)O.
What is the InChIKey of 2-[cyclopropyl(propyl)sulfamoyl]acetic acid?
The InChIKey is PMWWYTILWHWIBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO4S/c1-2-5-9(7-3-4-7)14(12,13)6-8(10)11/h7H,2-6H2,1H3,(H,10,11).
What are the key properties of 2-[cyclopropyl(propyl)sulfamoyl]acetic acid?
2-[cyclopropyl(propyl)sulfamoyl]acetic acid has a molecular weight of 221.28 g/mol, XLogP of 0.28, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl(propyl)sulfamoyl]acetic acid is sourced from PubChem (CID 43270267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).