2-(2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide

C11H9ClN2O2S — CID 707255

IUPAC2-(2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide
SMILESO=C(COc1ccccc1Cl)Nc1nccs1
InChIInChI=1S/C11H9ClN2O2S/c12-8-3-1-2-4-9(8)16-7-10(15)14-11-13-5-6-17-11/h1-6H,7H2,(H,13,14,15)
InChIKeyYYVYAGAXQNCOCN-UHFFFAOYSA-N
MW268.72 g/mol
LogP2.81
Rot. Bonds4

About 2-(2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide

2-(2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 707255) has the molecular formula C11H9ClN2O2S and a molecular weight of 268.72 g/mol. Its IUPAC name is 2-(2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide
PubChem CID707255
Molecular FormulaC11H9ClN2O2S
Molecular Weight268.72 g/mol
Exact Mass268.01
IUPAC Name2-(2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide
SMILESO=C(COc1ccccc1Cl)Nc1nccs1
InChIInChI=1S/C11H9ClN2O2S/c12-8-3-1-2-4-9(8)16-7-10(15)14-11-13-5-6-17-11/h1-6H,7H2,(H,13,14,15)
InChIKeyYYVYAGAXQNCOCN-UHFFFAOYSA-N
XLogP2.81
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.72
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide (CID 707255) is 2-(2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide is O=C(COc1ccccc1Cl)Nc1nccs1.
What is the InChIKey of 2-(2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is YYVYAGAXQNCOCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN2O2S/c12-8-3-1-2-4-9(8)16-7-10(15)14-11-13-5-6-17-11/h1-6H,7H2,(H,13,14,15).
What are the key properties of 2-(2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide?
2-(2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 268.72 g/mol, XLogP of 2.81, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 707255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).