2-(2-methylsulfonyl-1,3-thiazol-5-yl)acetamide

C6H8N2O3S2 — CID 173100919

IUPAC2-(2-methylsulfonyl-1,3-thiazol-5-yl)acetamide
SMILESCS(=O)(=O)c1ncc(CC(N)=O)s1
InChIInChI=1S/C6H8N2O3S2/c1-13(10,11)6-8-3-4(12-6)2-5(7)9/h3H,2H2,1H3,(H2,7,9)
InChIKeyBYSZNSMHVJVOMT-UHFFFAOYSA-N
MW220.27 g/mol
LogP-0.43
Rot. Bonds3

About 2-(2-methylsulfonyl-1,3-thiazol-5-yl)acetamide

2-(2-methylsulfonyl-1,3-thiazol-5-yl)acetamide (PubChem CID 173100919) has the molecular formula C6H8N2O3S2 and a molecular weight of 220.27 g/mol. Its IUPAC name is 2-(2-methylsulfonyl-1,3-thiazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(2-methylsulfonyl-1,3-thiazol-5-yl)acetamide
PubChem CID173100919
Molecular FormulaC6H8N2O3S2
Molecular Weight220.27 g/mol
Exact Mass220.00
IUPAC Name2-(2-methylsulfonyl-1,3-thiazol-5-yl)acetamide
SMILESCS(=O)(=O)c1ncc(CC(N)=O)s1
InChIInChI=1S/C6H8N2O3S2/c1-13(10,11)6-8-3-4(12-6)2-5(7)9/h3H,2H2,1H3,(H2,7,9)
InChIKeyBYSZNSMHVJVOMT-UHFFFAOYSA-N
XLogP-0.43
TPSA90.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 5-0.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylsulfonyl-1,3-thiazol-5-yl)acetamide?
The IUPAC name of 2-(2-methylsulfonyl-1,3-thiazol-5-yl)acetamide (CID 173100919) is 2-(2-methylsulfonyl-1,3-thiazol-5-yl)acetamide.
What is the SMILES notation for 2-(2-methylsulfonyl-1,3-thiazol-5-yl)acetamide?
The canonical SMILES for 2-(2-methylsulfonyl-1,3-thiazol-5-yl)acetamide is CS(=O)(=O)c1ncc(CC(N)=O)s1.
What is the InChIKey of 2-(2-methylsulfonyl-1,3-thiazol-5-yl)acetamide?
The InChIKey is BYSZNSMHVJVOMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O3S2/c1-13(10,11)6-8-3-4(12-6)2-5(7)9/h3H,2H2,1H3,(H2,7,9).
What are the key properties of 2-(2-methylsulfonyl-1,3-thiazol-5-yl)acetamide?
2-(2-methylsulfonyl-1,3-thiazol-5-yl)acetamide has a molecular weight of 220.27 g/mol, XLogP of -0.43, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylsulfonyl-1,3-thiazol-5-yl)acetamide is sourced from PubChem (CID 173100919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).