N-[4-(4-aminophenyl)-1,3-thiazol-2-yl]-2-phenoxyacetamide

C17H15N3O2S — CID 28861376

IUPACN-[4-(4-aminophenyl)-1,3-thiazol-2-yl]-2-phenoxyacetamide
SMILESNc1ccc(-c2csc(NC(=O)COc3ccccc3)n2)cc1
InChIInChI=1S/C17H15N3O2S/c18-13-8-6-12(7-9-13)15-11-23-17(19-15)20-16(21)10-22-14-4-2-1-3-5-14/h1-9,11H,10,18H2,(H,19,20,21)
InChIKeyBWASMJGTMHRIAZ-UHFFFAOYSA-N
MW325.39 g/mol
LogP3.41
Rot. Bonds5

About N-[4-(4-aminophenyl)-1,3-thiazol-2-yl]-2-phenoxyacetamide

N-[4-(4-aminophenyl)-1,3-thiazol-2-yl]-2-phenoxyacetamide (PubChem CID 28861376) has the molecular formula C17H15N3O2S and a molecular weight of 325.39 g/mol. Its IUPAC name is N-[4-(4-aminophenyl)-1,3-thiazol-2-yl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[4-(4-aminophenyl)-1,3-thiazol-2-yl]-2-phenoxyacetamide
PubChem CID28861376
Molecular FormulaC17H15N3O2S
Molecular Weight325.39 g/mol
Exact Mass325.09
IUPAC NameN-[4-(4-aminophenyl)-1,3-thiazol-2-yl]-2-phenoxyacetamide
SMILESNc1ccc(-c2csc(NC(=O)COc3ccccc3)n2)cc1
InChIInChI=1S/C17H15N3O2S/c18-13-8-6-12(7-9-13)15-11-23-17(19-15)20-16(21)10-22-14-4-2-1-3-5-14/h1-9,11H,10,18H2,(H,19,20,21)
InChIKeyBWASMJGTMHRIAZ-UHFFFAOYSA-N
XLogP3.41
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.39
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze N-[4-(4-aminophenyl)-1,3-thiazol-2-yl]-2-phenoxyacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-2-phenoxyacetamide
CID 3647343
N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-(4-phenylphenoxy)acetamide
CID 19178667
2-(4-tert-butylphenoxy)-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]acetamide
CID 19178615
2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-phenylacetamide
CID 28856207
N-[4-(4-aminophenyl)-1,3-thiazol-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 115949174
N-[4-(4-aminophenyl)-1,3-thiazol-2-yl]-4-(4-methoxyphenoxy)butanamide
CID 28861417
2-naphthalen-2-yloxy-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)acetamide
CID 3973055
2-(4-methoxyphenoxy)-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)acetamide
CID 7917274
N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]-2-(4-phenylphenoxy)acetamide
CID 19196755
N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]-2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetamide
CID 19178629
N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-(4-methylphenoxy)acetamide
CID 3986058
N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-2-(4-methoxyphenoxy)acetamide
CID 2715690

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-aminophenyl)-1,3-thiazol-2-yl]-2-phenoxyacetamide?
The IUPAC name of N-[4-(4-aminophenyl)-1,3-thiazol-2-yl]-2-phenoxyacetamide (CID 28861376) is N-[4-(4-aminophenyl)-1,3-thiazol-2-yl]-2-phenoxyacetamide.
What is the SMILES notation for N-[4-(4-aminophenyl)-1,3-thiazol-2-yl]-2-phenoxyacetamide?
The canonical SMILES for N-[4-(4-aminophenyl)-1,3-thiazol-2-yl]-2-phenoxyacetamide is Nc1ccc(-c2csc(NC(=O)COc3ccccc3)n2)cc1.
What is the InChIKey of N-[4-(4-aminophenyl)-1,3-thiazol-2-yl]-2-phenoxyacetamide?
The InChIKey is BWASMJGTMHRIAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2S/c18-13-8-6-12(7-9-13)15-11-23-17(19-15)20-16(21)10-22-14-4-2-1-3-5-14/h1-9,11H,10,18H2,(H,19,20,21).
What are the key properties of N-[4-(4-aminophenyl)-1,3-thiazol-2-yl]-2-phenoxyacetamide?
N-[4-(4-aminophenyl)-1,3-thiazol-2-yl]-2-phenoxyacetamide has a molecular weight of 325.39 g/mol, XLogP of 3.41, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-aminophenyl)-1,3-thiazol-2-yl]-2-phenoxyacetamide is sourced from PubChem (CID 28861376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).