4-methyl-2-oxo-N-propyl-3H-1,3-thiazole-5-sulfonamide

C7H12N2O3S2 — CID 43243223

IUPAC4-methyl-2-oxo-N-propyl-3H-1,3-thiazole-5-sulfonamide
SMILESCCCNS(=O)(=O)c1sc(=O)[nH]c1C
InChIInChI=1S/C7H12N2O3S2/c1-3-4-8-14(11,12)6-5(2)9-7(10)13-6/h8H,3-4H2,1-2H3,(H,9,10)
InChIKeyXUWVIJWRSBMFGL-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.43
Rot. Bonds4

About 4-methyl-2-oxo-N-propyl-3H-1,3-thiazole-5-sulfonamide

4-methyl-2-oxo-N-propyl-3H-1,3-thiazole-5-sulfonamide (PubChem CID 43243223) has the molecular formula C7H12N2O3S2 and a molecular weight of 236.32 g/mol. Its IUPAC name is 4-methyl-2-oxo-N-propyl-3H-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound Name4-methyl-2-oxo-N-propyl-3H-1,3-thiazole-5-sulfonamide
PubChem CID43243223
Molecular FormulaC7H12N2O3S2
Molecular Weight236.32 g/mol
Exact Mass236.03
IUPAC Name4-methyl-2-oxo-N-propyl-3H-1,3-thiazole-5-sulfonamide
SMILESCCCNS(=O)(=O)c1sc(=O)[nH]c1C
InChIInChI=1S/C7H12N2O3S2/c1-3-4-8-14(11,12)6-5(2)9-7(10)13-6/h8H,3-4H2,1-2H3,(H,9,10)
InChIKeyXUWVIJWRSBMFGL-UHFFFAOYSA-N
XLogP0.43
TPSA79.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-methyl-2-oxo-N-propyl-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

Related Compounds

N,4-dimethyl-2-oxo-N-(2,2,2-trifluoroethyl)-3H-1,3-thiazole-5-sulfonamide
CID 54884279
4-methyl-2-oxo-N-(3,3,3-trifluoropropyl)-3H-1,3-thiazole-5-sulfonamide
CID 55176308
4-methyl-2-oxo-N-(2,2,2-trifluoroethyl)-3H-1,3-thiazole-5-sulfonamide
CID 60985032
4-methyl-2-oxo-N-(2,2,3,3-tetrafluoropropyl)-3H-1,3-thiazole-5-sulfonamide
CID 106293630
4-methyl-2-oxo-N-[2-(trifluoromethylsulfanyl)ethyl]-3H-1,3-thiazole-5-sulfonamide
CID 106432230
N-(3-amino-2,2-difluoropropyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
CID 113577769
4-methyl-2-oxo-N-(4,4,4-trifluorobutan-2-yl)-3H-1,3-thiazole-5-sulfonamide
CID 114130623
N-(2,2-difluoroethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
CID 115408308
4-methyl-2-oxo-N-(4,4,4-trifluorobutyl)-3H-1,3-thiazole-5-sulfonamide
CID 115521685
N-(2,2-difluoroethyl)-N,4-dimethyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
CID 116316492
4-Methyl-2-oxo-2,3-dihydro-1,3-thiazole-5-sulfonamide
CID 16794146
N,4-dimethyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
CID 43132256

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-oxo-N-propyl-3H-1,3-thiazole-5-sulfonamide?
The IUPAC name of 4-methyl-2-oxo-N-propyl-3H-1,3-thiazole-5-sulfonamide (CID 43243223) is 4-methyl-2-oxo-N-propyl-3H-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for 4-methyl-2-oxo-N-propyl-3H-1,3-thiazole-5-sulfonamide?
The canonical SMILES for 4-methyl-2-oxo-N-propyl-3H-1,3-thiazole-5-sulfonamide is CCCNS(=O)(=O)c1sc(=O)[nH]c1C.
What is the InChIKey of 4-methyl-2-oxo-N-propyl-3H-1,3-thiazole-5-sulfonamide?
The InChIKey is XUWVIJWRSBMFGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O3S2/c1-3-4-8-14(11,12)6-5(2)9-7(10)13-6/h8H,3-4H2,1-2H3,(H,9,10).
What are the key properties of 4-methyl-2-oxo-N-propyl-3H-1,3-thiazole-5-sulfonamide?
4-methyl-2-oxo-N-propyl-3H-1,3-thiazole-5-sulfonamide has a molecular weight of 236.32 g/mol, XLogP of 0.43, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-oxo-N-propyl-3H-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 43243223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).