2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide

C9H11N3OS3 — CID 1235811

IUPAC2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide
SMILESCc1csc(NC(=O)CSC2=NCCS2)n1
InChIInChI=1S/C9H11N3OS3/c1-6-4-15-8(11-6)12-7(13)5-16-9-10-2-3-14-9/h4H,2-3,5H2,1H3,(H,11,12,13)
InChIKeyQNQFZQDOQUYPBK-UHFFFAOYSA-N
MW273.41 g/mol
LogP2.23
Rot. Bonds3

About 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide

2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide (PubChem CID 1235811) has the molecular formula C9H11N3OS3 and a molecular weight of 273.41 g/mol. Its IUPAC name is 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide
PubChem CID1235811
Molecular FormulaC9H11N3OS3
Molecular Weight273.41 g/mol
Exact Mass273.01
IUPAC Name2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide
SMILESCc1csc(NC(=O)CSC2=NCCS2)n1
InChIInChI=1S/C9H11N3OS3/c1-6-4-15-8(11-6)12-7(13)5-16-9-10-2-3-14-9/h4H,2-3,5H2,1H3,(H,11,12,13)
InChIKeyQNQFZQDOQUYPBK-UHFFFAOYSA-N
XLogP2.23
TPSA54.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.41
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(4-methyl-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

2-Acetamido-4-methylthiazole
CID 280907
2-Acetamido-4-chloromethylthiazole
CID 81963
Famotidine propanamide
CID 12760738
Acetamide, N-(4-(trifluoromethyl)-2-thiazolyl)-
CID 1229692
N-(4-methylthiazol-2-yl)propionamide
CID 3613666
N-(4-tert-butyl-1,3-thiazol-2-yl)-2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetamide
CID 4272947
2-((5-methyl-2-oxo-1,2-dihydropyrimidin-4-yl)thio)-N-(4-methylthiazol-2-yl)acetamide
CID 7184030
N-(4-methyl-1,3-thiazol-2-yl)-2-(1,3,4-thiadiazol-2-ylsulfanyl)acetamide
CID 18161307
2-(1-Methyl-1H-tetrazol-5-ylsulfanyl)-N-(4-methyl-thiazol-2-yl)-acetamide
CID 3145853
2,2,2-trifluoro-N-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 1229693
2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-N-(1,3-thiazol-2-yl)acetamide
CID 4450204
2-((4-amino-6-methyl-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl)thio)-N-(4-methylthiazol-2-yl)acetamide
CID 7196678

Frequently Asked Questions

What is the IUPAC name of 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide (CID 1235811) is 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide is Cc1csc(NC(=O)CSC2=NCCS2)n1.
What is the InChIKey of 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide?
The InChIKey is QNQFZQDOQUYPBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3OS3/c1-6-4-15-8(11-6)12-7(13)5-16-9-10-2-3-14-9/h4H,2-3,5H2,1H3,(H,11,12,13).
What are the key properties of 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide?
2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide has a molecular weight of 273.41 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 1235811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).