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

C11H11FN2OS2 — CID 644787

IUPAC2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(2-fluorophenyl)acetamide
SMILESO=C(CSC1=NCCS1)Nc1ccccc1F
InChIInChI=1S/C11H11FN2OS2/c12-8-3-1-2-4-9(8)14-10(15)7-17-11-13-5-6-16-11/h1-4H,5-7H2,(H,14,15)
InChIKeyWGXBAZPADBNZCM-UHFFFAOYSA-N
MW270.35 g/mol
LogP2.60
Rot. Bonds3

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

2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(2-fluorophenyl)acetamide (PubChem CID 644787) has the molecular formula C11H11FN2OS2 and a molecular weight of 270.35 g/mol. Its IUPAC name is 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(2-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(2-fluorophenyl)acetamide
PubChem CID644787
Molecular FormulaC11H11FN2OS2
Molecular Weight270.35 g/mol
Exact Mass270.03
IUPAC Name2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(2-fluorophenyl)acetamide
SMILESO=C(CSC1=NCCS1)Nc1ccccc1F
InChIInChI=1S/C11H11FN2OS2/c12-8-3-1-2-4-9(8)14-10(15)7-17-11-13-5-6-16-11/h1-4H,5-7H2,(H,14,15)
InChIKeyWGXBAZPADBNZCM-UHFFFAOYSA-N
XLogP2.60
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(2-fluorophenyl)acetamide?
The IUPAC name of 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(2-fluorophenyl)acetamide (CID 644787) is 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(2-fluorophenyl)acetamide.
What is the SMILES notation for 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(2-fluorophenyl)acetamide?
The canonical SMILES for 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(2-fluorophenyl)acetamide is O=C(CSC1=NCCS1)Nc1ccccc1F.
What is the InChIKey of 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(2-fluorophenyl)acetamide?
The InChIKey is WGXBAZPADBNZCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2OS2/c12-8-3-1-2-4-9(8)14-10(15)7-17-11-13-5-6-16-11/h1-4H,5-7H2,(H,14,15).
What are the key properties of 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(2-fluorophenyl)acetamide?
2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(2-fluorophenyl)acetamide has a molecular weight of 270.35 g/mol, XLogP of 2.60, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(2-fluorophenyl)acetamide is sourced from PubChem (CID 644787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).