2-(benzenesulfonamido)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide

C13H15N3O3S2 — CID 110446219

IUPAC2-(benzenesulfonamido)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide
SMILESO=C(CNS(=O)(=O)c1ccccc1)NCCc1nccs1
InChIInChI=1S/C13H15N3O3S2/c17-12(14-7-6-13-15-8-9-20-13)10-16-21(18,19)11-4-2-1-3-5-11/h1-5,8-9,16H,6-7,10H2,(H,14,17)
InChIKeyXFXNKDYCFBNESK-UHFFFAOYSA-N
MW325.41 g/mol
LogP0.78
Rot. Bonds7

About 2-(benzenesulfonamido)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide

2-(benzenesulfonamido)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide (PubChem CID 110446219) has the molecular formula C13H15N3O3S2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 2-(benzenesulfonamido)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(benzenesulfonamido)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide
PubChem CID110446219
Molecular FormulaC13H15N3O3S2
Molecular Weight325.41 g/mol
Exact Mass325.06
IUPAC Name2-(benzenesulfonamido)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide
SMILESO=C(CNS(=O)(=O)c1ccccc1)NCCc1nccs1
InChIInChI=1S/C13H15N3O3S2/c17-12(14-7-6-13-15-8-9-20-13)10-16-21(18,19)11-4-2-1-3-5-11/h1-5,8-9,16H,6-7,10H2,(H,14,17)
InChIKeyXFXNKDYCFBNESK-UHFFFAOYSA-N
XLogP0.78
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-(benzenesulfonamido)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide 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

PhSO2-Gly-(Me-Gly)-Arg-(2-thiazole)
CID 44453269
2-(4-Benzenesulfonyl-2-oxo-piperazin-1-yl)-N-[(R)-4-guanidino-1-(thiazole-2-carbonyl)-butyl]-acetamide
CID 44376079
2-[4-(benzenesulfonyl)-2-oxopiperazin-1-yl]-N-[(2S)-5-(diaminomethylideneamino)-1-oxo-1-(1,3-thiazol-2-yl)pentan-2-yl]acetamide
CID 44453375
2-(Phenylsulfanyl)-2-(1,3-thiazol-2-yl)ethanimidic acid
CID 208406
N-(1,3-thiazol-2-ylmethyl)benzenesulfonamide
CID 23020684
4-(benzenesulfonyl)-N-(1,3-thiazol-2-ylmethyl)piperazine-1-carboxamide
CID 132374221
Bes-Gly-Sar-DL-Arg-thiazol-2-yl
CID 75029597
3-[(3,4-difluorophenyl)sulfonylamino]-N-[(4-methyl-1,3-thiazol-2-yl)methyl]propanamide
CID 29527612
2-[benzenesulfonyl(1,3-thiazol-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 34001699
(2S)-2-{[(4-fluorophenyl)sulfonyl]amino}-N-(1,3-thiazol-4-ylmethyl)propanamide
CID 46388558
(2S)-2-{[(3-fluorophenyl)sulfonyl]amino}-N-(1,3-thiazol-4-ylmethyl)propanamide
CID 46388585
2-{[6-ethyl-3-(4-methylphenyl)-7-oxo-6,7-dihydroisothiazolo[4,5-d]pyrimidin-5-yl]thio}-N-(2-methylphenyl)acetamide
CID 46388586

Frequently Asked Questions

What is the IUPAC name of 2-(benzenesulfonamido)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide?
The IUPAC name of 2-(benzenesulfonamido)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide (CID 110446219) is 2-(benzenesulfonamido)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide.
What is the SMILES notation for 2-(benzenesulfonamido)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide?
The canonical SMILES for 2-(benzenesulfonamido)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide is O=C(CNS(=O)(=O)c1ccccc1)NCCc1nccs1.
What is the InChIKey of 2-(benzenesulfonamido)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide?
The InChIKey is XFXNKDYCFBNESK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3S2/c17-12(14-7-6-13-15-8-9-20-13)10-16-21(18,19)11-4-2-1-3-5-11/h1-5,8-9,16H,6-7,10H2,(H,14,17).
What are the key properties of 2-(benzenesulfonamido)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide?
2-(benzenesulfonamido)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide has a molecular weight of 325.41 g/mol, XLogP of 0.78, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzenesulfonamido)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide is sourced from PubChem (CID 110446219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).