(3R)-3-amino-N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide

C8H20N4O2S — CID 155056328

IUPAC(3R)-3-amino-N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide
SMILESCC(C)(CN)NS(=O)(=O)N1CC[C@@H](N)C1
InChIInChI=1S/C8H20N4O2S/c1-8(2,6-9)11-15(13,14)12-4-3-7(10)5-12/h7,11H,3-6,9-10H2,1-2H3/t7-/m1/s1
InChIKeyJDECLJSSJMZZKT-SSDOTTSWSA-N
MW236.34 g/mol
LogP-1.41
Rot. Bonds4

About (3R)-3-amino-N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide

(3R)-3-amino-N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide (PubChem CID 155056328) has the molecular formula C8H20N4O2S and a molecular weight of 236.34 g/mol. Its IUPAC name is (3R)-3-amino-N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide.

Molecular Properties

Compound Name(3R)-3-amino-N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide
PubChem CID155056328
Molecular FormulaC8H20N4O2S
Molecular Weight236.34 g/mol
Exact Mass236.13
IUPAC Name(3R)-3-amino-N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide
SMILESCC(C)(CN)NS(=O)(=O)N1CC[C@@H](N)C1
InChIInChI=1S/C8H20N4O2S/c1-8(2,6-9)11-15(13,14)12-4-3-7(10)5-12/h7,11H,3-6,9-10H2,1-2H3/t7-/m1/s1
InChIKeyJDECLJSSJMZZKT-SSDOTTSWSA-N
XLogP-1.41
TPSA101.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.34
LogP ≤ 5-1.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze (3R)-3-amino-N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide 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)-3-amino-N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide?
The IUPAC name of (3R)-3-amino-N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide (CID 155056328) is (3R)-3-amino-N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide.
What is the SMILES notation for (3R)-3-amino-N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide?
The canonical SMILES for (3R)-3-amino-N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide is CC(C)(CN)NS(=O)(=O)N1CC[C@@H](N)C1.
What is the InChIKey of (3R)-3-amino-N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide?
The InChIKey is JDECLJSSJMZZKT-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H20N4O2S/c1-8(2,6-9)11-15(13,14)12-4-3-7(10)5-12/h7,11H,3-6,9-10H2,1-2H3/t7-/m1/s1.
What are the key properties of (3R)-3-amino-N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide?
(3R)-3-amino-N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide has a molecular weight of 236.34 g/mol, XLogP of -1.41, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-amino-N-(1-amino-2-methylpropan-2-yl)pyrrolidine-1-sulfonamide is sourced from PubChem (CID 155056328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).