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

C14H16N2O2S — CID 804182

IUPAC2-(4-ethylphenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
SMILESCCc1ccc(OCC(=O)Nc2ncc(C)s2)cc1
InChIInChI=1S/C14H16N2O2S/c1-3-11-4-6-12(7-5-11)18-9-13(17)16-14-15-8-10(2)19-14/h4-8H,3,9H2,1-2H3,(H,15,16,17)
InChIKeyWKCMEDOBBYHYBI-UHFFFAOYSA-N
MW276.36 g/mol
LogP3.03
Rot. Bonds5

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

2-(4-ethylphenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide (PubChem CID 804182) has the molecular formula C14H16N2O2S and a molecular weight of 276.36 g/mol. Its IUPAC name is 2-(4-ethylphenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(4-ethylphenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
PubChem CID804182
Molecular FormulaC14H16N2O2S
Molecular Weight276.36 g/mol
Exact Mass276.09
IUPAC Name2-(4-ethylphenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
SMILESCCc1ccc(OCC(=O)Nc2ncc(C)s2)cc1
InChIInChI=1S/C14H16N2O2S/c1-3-11-4-6-12(7-5-11)18-9-13(17)16-14-15-8-10(2)19-14/h4-8H,3,9H2,1-2H3,(H,15,16,17)
InChIKeyWKCMEDOBBYHYBI-UHFFFAOYSA-N
XLogP3.03
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(4-ethylphenoxy)-N-(5-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

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(4-ethylphenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide (CID 804182) is 2-(4-ethylphenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(4-ethylphenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(4-ethylphenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide is CCc1ccc(OCC(=O)Nc2ncc(C)s2)cc1.
What is the InChIKey of 2-(4-ethylphenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
The InChIKey is WKCMEDOBBYHYBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2S/c1-3-11-4-6-12(7-5-11)18-9-13(17)16-14-15-8-10(2)19-14/h4-8H,3,9H2,1-2H3,(H,15,16,17).
What are the key properties of 2-(4-ethylphenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
2-(4-ethylphenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide has a molecular weight of 276.36 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenoxy)-N-(5-methyl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 804182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).