(3R)-N-ethylpyrrolidine-3-sulfonamide

C6H14N2O2S — CID 96995954

IUPAC(3R)-N-ethylpyrrolidine-3-sulfonamide
SMILESCCNS(=O)(=O)[C@@H]1CCNC1
InChIInChI=1S/C6H14N2O2S/c1-2-8-11(9,10)6-3-4-7-5-6/h6-8H,2-5H2,1H3/t6-/m1/s1
InChIKeyQGFAOVYTLNLVDJ-ZCFIWIBFSA-N
MW178.26 g/mol
LogP-0.71
Rot. Bonds3

About (3R)-N-ethylpyrrolidine-3-sulfonamide

(3R)-N-ethylpyrrolidine-3-sulfonamide (PubChem CID 96995954) has the molecular formula C6H14N2O2S and a molecular weight of 178.26 g/mol. Its IUPAC name is (3R)-N-ethylpyrrolidine-3-sulfonamide.

Molecular Properties

Compound Name(3R)-N-ethylpyrrolidine-3-sulfonamide
PubChem CID96995954
Molecular FormulaC6H14N2O2S
Molecular Weight178.26 g/mol
Exact Mass178.08
IUPAC Name(3R)-N-ethylpyrrolidine-3-sulfonamide
SMILESCCNS(=O)(=O)[C@@H]1CCNC1
InChIInChI=1S/C6H14N2O2S/c1-2-8-11(9,10)6-3-4-7-5-6/h6-8H,2-5H2,1H3/t6-/m1/s1
InChIKeyQGFAOVYTLNLVDJ-ZCFIWIBFSA-N
XLogP-0.71
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.26
LogP ≤ 5-0.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methylbutyl)pyrrolidine-3-sulfonamide
CID 65421561
N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrrolidine-3-sulfonamide
CID 114285111
N-(2-sulfamoylethyl)pyrrolidine-3-sulfonamide
CID 65420912
N-[2-(pyrrolidin-3-ylsulfonylamino)ethyl]acetamide
CID 65420913
N-[(2-methylcyclohexyl)methyl]pyrrolidine-3-sulfonamide
CID 65422436
N-(3-sulfamoylpropyl)pyrrolidine-3-sulfonamide
CID 65422646
N-(2-cyclohexylethyl)pyrrolidine-3-sulfonamide
CID 65421145
N-benzylpyrrolidine-3-sulfonamide
CID 65420907
N-(4-methylpentan-2-yl)pyrrolidine-3-sulfonamide
CID 65420704
N-[(4-ethylmorpholin-2-yl)methyl]pyrrolidine-3-sulfonamide
CID 114401404
N-[2-[ethyl(methyl)amino]ethyl]piperidine-3-sulfonamide
CID 62636011
N-(2-morpholin-4-ylethyl)pyrrolidine-3-sulfonamide
CID 65421126

Frequently Asked Questions

What is the IUPAC name of (3R)-N-ethylpyrrolidine-3-sulfonamide?
The IUPAC name of (3R)-N-ethylpyrrolidine-3-sulfonamide (CID 96995954) is (3R)-N-ethylpyrrolidine-3-sulfonamide.
What is the SMILES notation for (3R)-N-ethylpyrrolidine-3-sulfonamide?
The canonical SMILES for (3R)-N-ethylpyrrolidine-3-sulfonamide is CCNS(=O)(=O)[C@@H]1CCNC1.
What is the InChIKey of (3R)-N-ethylpyrrolidine-3-sulfonamide?
The InChIKey is QGFAOVYTLNLVDJ-ZCFIWIBFSA-N. The full InChI is InChI=1S/C6H14N2O2S/c1-2-8-11(9,10)6-3-4-7-5-6/h6-8H,2-5H2,1H3/t6-/m1/s1.
What are the key properties of (3R)-N-ethylpyrrolidine-3-sulfonamide?
(3R)-N-ethylpyrrolidine-3-sulfonamide has a molecular weight of 178.26 g/mol, XLogP of -0.71, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-ethylpyrrolidine-3-sulfonamide is sourced from PubChem (CID 96995954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).