(3R,4R)-3-[ethylsulfamoyl(methyl)amino]-4-hydroxypyrrolidine

C7H17N3O3S — CID 104978123

IUPAC(3R,4R)-3-[ethylsulfamoyl(methyl)amino]-4-hydroxypyrrolidine
SMILESCCNS(=O)(=O)N(C)[C@@H]1CNC[C@H]1O
InChIInChI=1S/C7H17N3O3S/c1-3-9-14(12,13)10(2)6-4-8-5-7(6)11/h6-9,11H,3-5H2,1-2H3/t6-,7-/m1/s1
InChIKeySSQGNVTZDXHADY-RNFRBKRXSA-N
MW223.30 g/mol
LogP-1.89
Rot. Bonds4

About (3R,4R)-3-[ethylsulfamoyl(methyl)amino]-4-hydroxypyrrolidine

(3R,4R)-3-[ethylsulfamoyl(methyl)amino]-4-hydroxypyrrolidine (PubChem CID 104978123) has the molecular formula C7H17N3O3S and a molecular weight of 223.30 g/mol. Its IUPAC name is (3R,4R)-3-[ethylsulfamoyl(methyl)amino]-4-hydroxypyrrolidine.

Molecular Properties

Compound Name(3R,4R)-3-[ethylsulfamoyl(methyl)amino]-4-hydroxypyrrolidine
PubChem CID104978123
Molecular FormulaC7H17N3O3S
Molecular Weight223.30 g/mol
Exact Mass223.10
IUPAC Name(3R,4R)-3-[ethylsulfamoyl(methyl)amino]-4-hydroxypyrrolidine
SMILESCCNS(=O)(=O)N(C)[C@@H]1CNC[C@H]1O
InChIInChI=1S/C7H17N3O3S/c1-3-9-14(12,13)10(2)6-4-8-5-7(6)11/h6-9,11H,3-5H2,1-2H3/t6-,7-/m1/s1
InChIKeySSQGNVTZDXHADY-RNFRBKRXSA-N
XLogP-1.89
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.30
LogP ≤ 5-1.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze (3R,4R)-3-[ethylsulfamoyl(methyl)amino]-4-hydroxypyrrolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3R,4R)-3-[ethylsulfamoyl(methyl)amino]-4-hydroxypyrrolidine?
The IUPAC name of (3R,4R)-3-[ethylsulfamoyl(methyl)amino]-4-hydroxypyrrolidine (CID 104978123) is (3R,4R)-3-[ethylsulfamoyl(methyl)amino]-4-hydroxypyrrolidine.
What is the SMILES notation for (3R,4R)-3-[ethylsulfamoyl(methyl)amino]-4-hydroxypyrrolidine?
The canonical SMILES for (3R,4R)-3-[ethylsulfamoyl(methyl)amino]-4-hydroxypyrrolidine is CCNS(=O)(=O)N(C)[C@@H]1CNC[C@H]1O.
What is the InChIKey of (3R,4R)-3-[ethylsulfamoyl(methyl)amino]-4-hydroxypyrrolidine?
The InChIKey is SSQGNVTZDXHADY-RNFRBKRXSA-N. The full InChI is InChI=1S/C7H17N3O3S/c1-3-9-14(12,13)10(2)6-4-8-5-7(6)11/h6-9,11H,3-5H2,1-2H3/t6-,7-/m1/s1.
What are the key properties of (3R,4R)-3-[ethylsulfamoyl(methyl)amino]-4-hydroxypyrrolidine?
(3R,4R)-3-[ethylsulfamoyl(methyl)amino]-4-hydroxypyrrolidine has a molecular weight of 223.30 g/mol, XLogP of -1.89, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4R)-3-[ethylsulfamoyl(methyl)amino]-4-hydroxypyrrolidine is sourced from PubChem (CID 104978123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).