(3S)-3-methoxy-4-[[methyl(propan-2-yl)sulfamoyl]amino]pyrrolidine

C9H21N3O3S — CID 61454024

IUPAC(3S)-3-methoxy-4-[[methyl(propan-2-yl)sulfamoyl]amino]pyrrolidine
SMILESCO[C@H]1CNCC1NS(=O)(=O)N(C)C(C)C
InChIInChI=1S/C9H21N3O3S/c1-7(2)12(3)16(13,14)11-8-5-10-6-9(8)15-4/h7-11H,5-6H2,1-4H3/t8?,9-/m0/s1
InChIKeyGYXRPSXKFKSNRO-GKAPJAKFSA-N
MW251.35 g/mol
LogP-0.85
Rot. Bonds5

About (3S)-3-methoxy-4-[[methyl(propan-2-yl)sulfamoyl]amino]pyrrolidine

(3S)-3-methoxy-4-[[methyl(propan-2-yl)sulfamoyl]amino]pyrrolidine (PubChem CID 61454024) has the molecular formula C9H21N3O3S and a molecular weight of 251.35 g/mol. Its IUPAC name is (3S)-3-methoxy-4-[[methyl(propan-2-yl)sulfamoyl]amino]pyrrolidine.

Molecular Properties

Compound Name(3S)-3-methoxy-4-[[methyl(propan-2-yl)sulfamoyl]amino]pyrrolidine
PubChem CID61454024
Molecular FormulaC9H21N3O3S
Molecular Weight251.35 g/mol
Exact Mass251.13
IUPAC Name(3S)-3-methoxy-4-[[methyl(propan-2-yl)sulfamoyl]amino]pyrrolidine
SMILESCO[C@H]1CNCC1NS(=O)(=O)N(C)C(C)C
InChIInChI=1S/C9H21N3O3S/c1-7(2)12(3)16(13,14)11-8-5-10-6-9(8)15-4/h7-11H,5-6H2,1-4H3/t8?,9-/m0/s1
InChIKeyGYXRPSXKFKSNRO-GKAPJAKFSA-N
XLogP-0.85
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.35
LogP ≤ 5-0.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (3S)-3-methoxy-4-[[methyl(propan-2-yl)sulfamoyl]amino]pyrrolidine 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 (3S)-3-methoxy-4-[[methyl(propan-2-yl)sulfamoyl]amino]pyrrolidine?
The IUPAC name of (3S)-3-methoxy-4-[[methyl(propan-2-yl)sulfamoyl]amino]pyrrolidine (CID 61454024) is (3S)-3-methoxy-4-[[methyl(propan-2-yl)sulfamoyl]amino]pyrrolidine.
What is the SMILES notation for (3S)-3-methoxy-4-[[methyl(propan-2-yl)sulfamoyl]amino]pyrrolidine?
The canonical SMILES for (3S)-3-methoxy-4-[[methyl(propan-2-yl)sulfamoyl]amino]pyrrolidine is CO[C@H]1CNCC1NS(=O)(=O)N(C)C(C)C.
What is the InChIKey of (3S)-3-methoxy-4-[[methyl(propan-2-yl)sulfamoyl]amino]pyrrolidine?
The InChIKey is GYXRPSXKFKSNRO-GKAPJAKFSA-N. The full InChI is InChI=1S/C9H21N3O3S/c1-7(2)12(3)16(13,14)11-8-5-10-6-9(8)15-4/h7-11H,5-6H2,1-4H3/t8?,9-/m0/s1.
What are the key properties of (3S)-3-methoxy-4-[[methyl(propan-2-yl)sulfamoyl]amino]pyrrolidine?
(3S)-3-methoxy-4-[[methyl(propan-2-yl)sulfamoyl]amino]pyrrolidine has a molecular weight of 251.35 g/mol, XLogP of -0.85, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-methoxy-4-[[methyl(propan-2-yl)sulfamoyl]amino]pyrrolidine is sourced from PubChem (CID 61454024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).