N,4-dimethyl-2-oxo-N-(1-thiophen-2-ylethyl)-3H-1,3-thiazole-5-sulfonamide

C11H14N2O3S3 — CID 60724800

IUPACN,4-dimethyl-2-oxo-N-(1-thiophen-2-ylethyl)-3H-1,3-thiazole-5-sulfonamide
SMILESCc1[nH]c(=O)sc1S(=O)(=O)N(C)C(C)c1cccs1
InChIInChI=1S/C11H14N2O3S3/c1-7-10(18-11(14)12-7)19(15,16)13(3)8(2)9-5-4-6-17-9/h4-6,8H,1-3H3,(H,12,14)
InChIKeyYZEMJJJMUHOUQA-UHFFFAOYSA-N
MW318.45 g/mol
LogP2.19
Rot. Bonds4

About N,4-dimethyl-2-oxo-N-(1-thiophen-2-ylethyl)-3H-1,3-thiazole-5-sulfonamide

N,4-dimethyl-2-oxo-N-(1-thiophen-2-ylethyl)-3H-1,3-thiazole-5-sulfonamide (PubChem CID 60724800) has the molecular formula C11H14N2O3S3 and a molecular weight of 318.45 g/mol. Its IUPAC name is N,4-dimethyl-2-oxo-N-(1-thiophen-2-ylethyl)-3H-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound NameN,4-dimethyl-2-oxo-N-(1-thiophen-2-ylethyl)-3H-1,3-thiazole-5-sulfonamide
PubChem CID60724800
Molecular FormulaC11H14N2O3S3
Molecular Weight318.45 g/mol
Exact Mass318.02
IUPAC NameN,4-dimethyl-2-oxo-N-(1-thiophen-2-ylethyl)-3H-1,3-thiazole-5-sulfonamide
SMILESCc1[nH]c(=O)sc1S(=O)(=O)N(C)C(C)c1cccs1
InChIInChI=1S/C11H14N2O3S3/c1-7-10(18-11(14)12-7)19(15,16)13(3)8(2)9-5-4-6-17-9/h4-6,8H,1-3H3,(H,12,14)
InChIKeyYZEMJJJMUHOUQA-UHFFFAOYSA-N
XLogP2.19
TPSA70.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.45
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N,4-dimethyl-2-oxo-N-(1-thiophen-2-ylethyl)-3H-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 N,4-dimethyl-2-oxo-N-(1-thiophen-2-ylethyl)-3H-1,3-thiazole-5-sulfonamide?
The IUPAC name of N,4-dimethyl-2-oxo-N-(1-thiophen-2-ylethyl)-3H-1,3-thiazole-5-sulfonamide (CID 60724800) is N,4-dimethyl-2-oxo-N-(1-thiophen-2-ylethyl)-3H-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for N,4-dimethyl-2-oxo-N-(1-thiophen-2-ylethyl)-3H-1,3-thiazole-5-sulfonamide?
The canonical SMILES for N,4-dimethyl-2-oxo-N-(1-thiophen-2-ylethyl)-3H-1,3-thiazole-5-sulfonamide is Cc1[nH]c(=O)sc1S(=O)(=O)N(C)C(C)c1cccs1.
What is the InChIKey of N,4-dimethyl-2-oxo-N-(1-thiophen-2-ylethyl)-3H-1,3-thiazole-5-sulfonamide?
The InChIKey is YZEMJJJMUHOUQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O3S3/c1-7-10(18-11(14)12-7)19(15,16)13(3)8(2)9-5-4-6-17-9/h4-6,8H,1-3H3,(H,12,14).
What are the key properties of N,4-dimethyl-2-oxo-N-(1-thiophen-2-ylethyl)-3H-1,3-thiazole-5-sulfonamide?
N,4-dimethyl-2-oxo-N-(1-thiophen-2-ylethyl)-3H-1,3-thiazole-5-sulfonamide has a molecular weight of 318.45 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-2-oxo-N-(1-thiophen-2-ylethyl)-3H-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 60724800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).