N-[5-(4-methylphenyl)sulfanyl-1,3-thiazol-2-yl]acetamide

C12H12N2OS2 — CID 134938465

IUPACN-[5-(4-methylphenyl)sulfanyl-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1ncc(Sc2ccc(C)cc2)s1
InChIInChI=1S/C12H12N2OS2/c1-8-3-5-10(6-4-8)16-11-7-13-12(17-11)14-9(2)15/h3-7H,1-2H3,(H,13,14,15)
InChIKeyDSUXDWGFCHBPCI-UHFFFAOYSA-N
MW264.38 g/mol
LogP3.56
Rot. Bonds3

About N-[5-(4-methylphenyl)sulfanyl-1,3-thiazol-2-yl]acetamide

N-[5-(4-methylphenyl)sulfanyl-1,3-thiazol-2-yl]acetamide (PubChem CID 134938465) has the molecular formula C12H12N2OS2 and a molecular weight of 264.38 g/mol. Its IUPAC name is N-[5-(4-methylphenyl)sulfanyl-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound NameN-[5-(4-methylphenyl)sulfanyl-1,3-thiazol-2-yl]acetamide
PubChem CID134938465
Molecular FormulaC12H12N2OS2
Molecular Weight264.38 g/mol
Exact Mass264.04
IUPAC NameN-[5-(4-methylphenyl)sulfanyl-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1ncc(Sc2ccc(C)cc2)s1
InChIInChI=1S/C12H12N2OS2/c1-8-3-5-10(6-4-8)16-11-7-13-12(17-11)14-9(2)15/h3-7H,1-2H3,(H,13,14,15)
InChIKeyDSUXDWGFCHBPCI-UHFFFAOYSA-N
XLogP3.56
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.38
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[5-(4-methylphenyl)sulfanyl-1,3-thiazol-2-yl]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

N-(5-phenylsulfanyl-1,3-thiazol-2-yl)acetamide
CID 15786742
N-[5-[(2-acetamido-1,3-thiazol-5-yl)sulfanyl]-1,3-thiazol-2-yl]acetamide
CID 54507195
tert-butyl 2-[(2-acetamido-1,3-thiazol-5-yl)sulfanyl]acetate
CID 5329661
N-[5-(1-methyltetrazol-5-yl)sulfanyl-1,3-thiazol-2-yl]acetamide
CID 15729185
[5-(4-methylsulfanylphenyl)sulfanyl-1,3-thiazol-2-yl]methylcarbamic acid
CID 130345222
N-[5-[4-(4-acetylpiperazine-1-carbonyl)phenyl]sulfanyl-1,3-thiazol-2-yl]-4-(dimethylamino)benzamide
CID 20635500
N-(5-acetyl-1,3-thiazol-2-yl)acetamide;hydrobromide
CID 141437106
methyl 4-[[2-(methylamino)-1,3-thiazol-5-yl]sulfanyl]pyridine-2-carboxylate
CID 59200463
N-[5-[[5-(2-fluorophenyl)-1,3-oxazol-2-yl]methylsulfanyl]-1,3-thiazol-2-yl]acetamide
CID 22971261
N-[4-(5-formylthiophen-2-yl)sulfanylphenyl]acetamide
CID 113403944
N-[4-[5-(4-methylphenyl)thiophen-2-yl]-1,3-thiazol-2-yl]acetamide
CID 35271808
2-acetamido-1,3-thiazole-5-sulfonic acid;hydrochloride
CID 174821930

Frequently Asked Questions

What is the IUPAC name of N-[5-(4-methylphenyl)sulfanyl-1,3-thiazol-2-yl]acetamide?
The IUPAC name of N-[5-(4-methylphenyl)sulfanyl-1,3-thiazol-2-yl]acetamide (CID 134938465) is N-[5-(4-methylphenyl)sulfanyl-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for N-[5-(4-methylphenyl)sulfanyl-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for N-[5-(4-methylphenyl)sulfanyl-1,3-thiazol-2-yl]acetamide is CC(=O)Nc1ncc(Sc2ccc(C)cc2)s1.
What is the InChIKey of N-[5-(4-methylphenyl)sulfanyl-1,3-thiazol-2-yl]acetamide?
The InChIKey is DSUXDWGFCHBPCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2OS2/c1-8-3-5-10(6-4-8)16-11-7-13-12(17-11)14-9(2)15/h3-7H,1-2H3,(H,13,14,15).
What are the key properties of N-[5-(4-methylphenyl)sulfanyl-1,3-thiazol-2-yl]acetamide?
N-[5-(4-methylphenyl)sulfanyl-1,3-thiazol-2-yl]acetamide has a molecular weight of 264.38 g/mol, XLogP of 3.56, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(4-methylphenyl)sulfanyl-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 134938465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).