2-amino-N-propan-2-yl-1,3-thiazole-5-sulfonamide

C6H11N3O2S2 — CID 87417015

IUPAC2-amino-N-propan-2-yl-1,3-thiazole-5-sulfonamide
SMILESCC(C)NS(=O)(=O)c1cnc(N)s1
InChIInChI=1S/C6H11N3O2S2/c1-4(2)9-13(10,11)5-3-8-6(7)12-5/h3-4,9H,1-2H3,(H2,7,8)
InChIKeyXGCILFCFFZLGBM-UHFFFAOYSA-N
MW221.31 g/mol
LogP0.41
Rot. Bonds3

About 2-amino-N-propan-2-yl-1,3-thiazole-5-sulfonamide

2-amino-N-propan-2-yl-1,3-thiazole-5-sulfonamide (PubChem CID 87417015) has the molecular formula C6H11N3O2S2 and a molecular weight of 221.31 g/mol. Its IUPAC name is 2-amino-N-propan-2-yl-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound Name2-amino-N-propan-2-yl-1,3-thiazole-5-sulfonamide
PubChem CID87417015
Molecular FormulaC6H11N3O2S2
Molecular Weight221.31 g/mol
Exact Mass221.03
IUPAC Name2-amino-N-propan-2-yl-1,3-thiazole-5-sulfonamide
SMILESCC(C)NS(=O)(=O)c1cnc(N)s1
InChIInChI=1S/C6H11N3O2S2/c1-4(2)9-13(10,11)5-3-8-6(7)12-5/h3-4,9H,1-2H3,(H2,7,8)
InChIKeyXGCILFCFFZLGBM-UHFFFAOYSA-N
XLogP0.41
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.31
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-amino-N-propan-2-yl-1,3-thiazole-5-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 2-amino-N-propan-2-yl-1,3-thiazole-5-sulfonamide?
The IUPAC name of 2-amino-N-propan-2-yl-1,3-thiazole-5-sulfonamide (CID 87417015) is 2-amino-N-propan-2-yl-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for 2-amino-N-propan-2-yl-1,3-thiazole-5-sulfonamide?
The canonical SMILES for 2-amino-N-propan-2-yl-1,3-thiazole-5-sulfonamide is CC(C)NS(=O)(=O)c1cnc(N)s1.
What is the InChIKey of 2-amino-N-propan-2-yl-1,3-thiazole-5-sulfonamide?
The InChIKey is XGCILFCFFZLGBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O2S2/c1-4(2)9-13(10,11)5-3-8-6(7)12-5/h3-4,9H,1-2H3,(H2,7,8).
What are the key properties of 2-amino-N-propan-2-yl-1,3-thiazole-5-sulfonamide?
2-amino-N-propan-2-yl-1,3-thiazole-5-sulfonamide has a molecular weight of 221.31 g/mol, XLogP of 0.41, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-propan-2-yl-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 87417015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).