N-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl]-2-phenylacetamide

C20H20N2O2S — CID 35344893

IUPACN-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl]-2-phenylacetamide
SMILESCOc1ccc(-c2nc(CCNC(=O)Cc3ccccc3)cs2)cc1
InChIInChI=1S/C20H20N2O2S/c1-24-18-9-7-16(8-10-18)20-22-17(14-25-20)11-12-21-19(23)13-15-5-3-2-4-6-15/h2-10,14H,11-13H2,1H3,(H,21,23)
InChIKeyZHUUXMMFKMAQKU-UHFFFAOYSA-N
MW352.46 g/mol
LogP3.72
Rot. Bonds7

About N-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl]-2-phenylacetamide

N-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl]-2-phenylacetamide (PubChem CID 35344893) has the molecular formula C20H20N2O2S and a molecular weight of 352.46 g/mol. Its IUPAC name is N-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl]-2-phenylacetamide
PubChem CID35344893
Molecular FormulaC20H20N2O2S
Molecular Weight352.46 g/mol
Exact Mass352.12
IUPAC NameN-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl]-2-phenylacetamide
SMILESCOc1ccc(-c2nc(CCNC(=O)Cc3ccccc3)cs2)cc1
InChIInChI=1S/C20H20N2O2S/c1-24-18-9-7-16(8-10-18)20-22-17(14-25-20)11-12-21-19(23)13-15-5-3-2-4-6-15/h2-10,14H,11-13H2,1H3,(H,21,23)
InChIKeyZHUUXMMFKMAQKU-UHFFFAOYSA-N
XLogP3.72
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.46
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl]-2-phenylacetamide 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 N-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl]-2-phenylacetamide?
The IUPAC name of N-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl]-2-phenylacetamide (CID 35344893) is N-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl]-2-phenylacetamide.
What is the SMILES notation for N-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl]-2-phenylacetamide?
The canonical SMILES for N-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl]-2-phenylacetamide is COc1ccc(-c2nc(CCNC(=O)Cc3ccccc3)cs2)cc1.
What is the InChIKey of N-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl]-2-phenylacetamide?
The InChIKey is ZHUUXMMFKMAQKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2S/c1-24-18-9-7-16(8-10-18)20-22-17(14-25-20)11-12-21-19(23)13-15-5-3-2-4-6-15/h2-10,14H,11-13H2,1H3,(H,21,23).
What are the key properties of N-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl]-2-phenylacetamide?
N-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl]-2-phenylacetamide has a molecular weight of 352.46 g/mol, XLogP of 3.72, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl]-2-phenylacetamide is sourced from PubChem (CID 35344893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).