3-[2-methoxyethylsulfamoyl(propyl)amino]pyrrolidine

C10H23N3O3S — CID 114814259

IUPAC3-[2-methoxyethylsulfamoyl(propyl)amino]pyrrolidine
SMILESCCCN(C1CCNC1)S(=O)(=O)NCCOC
InChIInChI=1S/C10H23N3O3S/c1-3-7-13(10-4-5-11-9-10)17(14,15)12-6-8-16-2/h10-12H,3-9H2,1-2H3
InChIKeyRKKOKZYXLWOVJW-UHFFFAOYSA-N
MW265.38 g/mol
LogP-0.46
Rot. Bonds8

About 3-[2-methoxyethylsulfamoyl(propyl)amino]pyrrolidine

3-[2-methoxyethylsulfamoyl(propyl)amino]pyrrolidine (PubChem CID 114814259) has the molecular formula C10H23N3O3S and a molecular weight of 265.38 g/mol. Its IUPAC name is 3-[2-methoxyethylsulfamoyl(propyl)amino]pyrrolidine.

Molecular Properties

Compound Name3-[2-methoxyethylsulfamoyl(propyl)amino]pyrrolidine
PubChem CID114814259
Molecular FormulaC10H23N3O3S
Molecular Weight265.38 g/mol
Exact Mass265.15
IUPAC Name3-[2-methoxyethylsulfamoyl(propyl)amino]pyrrolidine
SMILESCCCN(C1CCNC1)S(=O)(=O)NCCOC
InChIInChI=1S/C10H23N3O3S/c1-3-7-13(10-4-5-11-9-10)17(14,15)12-6-8-16-2/h10-12H,3-9H2,1-2H3
InChIKeyRKKOKZYXLWOVJW-UHFFFAOYSA-N
XLogP-0.46
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.38
LogP ≤ 5-0.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-propyl-N-pyrrolidin-3-ylethanesulfonamide
CID 60805146
3-[cyclopropyl(2-methoxyethylsulfamoyl)amino]propanoic acid
CID 114814428
methyl 2-[propyl(pyrrolidin-3-yl)sulfamoyl]propanoate
CID 63300934
N-propyl-N-pyrrolidin-3-ylpropane-1-sulfonamide;hydrochloride
CID 119976707
N-(2-methoxyethylcarbamoyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide
CID 63304558
methyl 2-methyl-5-[propyl(pyrrolidin-3-yl)sulfamoyl]benzoate;hydrochloride
CID 119976853
N-propyl-N-pyrrolidin-3-ylprop-2-ene-1-sulfonamide
CID 79673607
N-piperidin-3-yl-N-propylethanesulfonamide
CID 60806396
4-methoxy-2,5-dimethyl-N-propyl-N-pyrrolidin-3-ylbenzenesulfonamide
CID 119976561
N-[cyclohexyl(methyl)sulfamoyl]-N-propylpyrrolidin-3-amine;hydrochloride
CID 119976327
5-methoxy-N-propyl-N-pyrrolidin-3-ylpentanamide
CID 119531804
5-bromo-2-methoxy-N-propyl-N-pyrrolidin-3-ylbenzenesulfonamide
CID 63301153

Frequently Asked Questions

What is the IUPAC name of 3-[2-methoxyethylsulfamoyl(propyl)amino]pyrrolidine?
The IUPAC name of 3-[2-methoxyethylsulfamoyl(propyl)amino]pyrrolidine (CID 114814259) is 3-[2-methoxyethylsulfamoyl(propyl)amino]pyrrolidine.
What is the SMILES notation for 3-[2-methoxyethylsulfamoyl(propyl)amino]pyrrolidine?
The canonical SMILES for 3-[2-methoxyethylsulfamoyl(propyl)amino]pyrrolidine is CCCN(C1CCNC1)S(=O)(=O)NCCOC.
What is the InChIKey of 3-[2-methoxyethylsulfamoyl(propyl)amino]pyrrolidine?
The InChIKey is RKKOKZYXLWOVJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O3S/c1-3-7-13(10-4-5-11-9-10)17(14,15)12-6-8-16-2/h10-12H,3-9H2,1-2H3.
What are the key properties of 3-[2-methoxyethylsulfamoyl(propyl)amino]pyrrolidine?
3-[2-methoxyethylsulfamoyl(propyl)amino]pyrrolidine has a molecular weight of 265.38 g/mol, XLogP of -0.46, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-methoxyethylsulfamoyl(propyl)amino]pyrrolidine is sourced from PubChem (CID 114814259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).