4-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-2-sulfonamide

C10H13N3O2S3 — CID 54958513

IUPAC4-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-2-sulfonamide
SMILESCC(C)c1csc(NS(=O)(=O)c2cc(N)cs2)n1
InChIInChI=1S/C10H13N3O2S3/c1-6(2)8-5-17-10(12-8)13-18(14,15)9-3-7(11)4-16-9/h3-6H,11H2,1-2H3,(H,12,13)
InChIKeyAHHMNVIPODOZQN-UHFFFAOYSA-N
MW303.43 g/mol
LogP2.71
Rot. Bonds4

About 4-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-2-sulfonamide

4-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-2-sulfonamide (PubChem CID 54958513) has the molecular formula C10H13N3O2S3 and a molecular weight of 303.43 g/mol. Its IUPAC name is 4-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name4-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-2-sulfonamide
PubChem CID54958513
Molecular FormulaC10H13N3O2S3
Molecular Weight303.43 g/mol
Exact Mass303.02
IUPAC Name4-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-2-sulfonamide
SMILESCC(C)c1csc(NS(=O)(=O)c2cc(N)cs2)n1
InChIInChI=1S/C10H13N3O2S3/c1-6(2)8-5-17-10(12-8)13-18(14,15)9-3-7(11)4-16-9/h3-6H,11H2,1-2H3,(H,12,13)
InChIKeyAHHMNVIPODOZQN-UHFFFAOYSA-N
XLogP2.71
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.43
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-2-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 4-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-2-sulfonamide?
The IUPAC name of 4-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-2-sulfonamide (CID 54958513) is 4-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-2-sulfonamide.
What is the SMILES notation for 4-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-2-sulfonamide?
The canonical SMILES for 4-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-2-sulfonamide is CC(C)c1csc(NS(=O)(=O)c2cc(N)cs2)n1.
What is the InChIKey of 4-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-2-sulfonamide?
The InChIKey is AHHMNVIPODOZQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2S3/c1-6(2)8-5-17-10(12-8)13-18(14,15)9-3-7(11)4-16-9/h3-6H,11H2,1-2H3,(H,12,13).
What are the key properties of 4-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-2-sulfonamide?
4-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-2-sulfonamide has a molecular weight of 303.43 g/mol, XLogP of 2.71, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 54958513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).