2-(4-acetylphenoxy)-N-(2-iodophenyl)acetamide

C16H14INO3 — CID 2621387

IUPAC2-(4-acetylphenoxy)-N-(2-iodophenyl)acetamide
SMILESCC(=O)c1ccc(OCC(=O)Nc2ccccc2I)cc1
InChIInChI=1S/C16H14INO3/c1-11(19)12-6-8-13(9-7-12)21-10-16(20)18-15-5-3-2-4-14(15)17/h2-9H,10H2,1H3,(H,18,20)
InChIKeyKSYDAVXGPLUMLR-UHFFFAOYSA-N
MW395.20 g/mol
LogP3.51
Rot. Bonds5

About 2-(4-acetylphenoxy)-N-(2-iodophenyl)acetamide

2-(4-acetylphenoxy)-N-(2-iodophenyl)acetamide (PubChem CID 2621387) has the molecular formula C16H14INO3 and a molecular weight of 395.20 g/mol. Its IUPAC name is 2-(4-acetylphenoxy)-N-(2-iodophenyl)acetamide.

Molecular Properties

Compound Name2-(4-acetylphenoxy)-N-(2-iodophenyl)acetamide
PubChem CID2621387
Molecular FormulaC16H14INO3
Molecular Weight395.20 g/mol
Exact Mass395.00
IUPAC Name2-(4-acetylphenoxy)-N-(2-iodophenyl)acetamide
SMILESCC(=O)c1ccc(OCC(=O)Nc2ccccc2I)cc1
InChIInChI=1S/C16H14INO3/c1-11(19)12-6-8-13(9-7-12)21-10-16(20)18-15-5-3-2-4-14(15)17/h2-9H,10H2,1H3,(H,18,20)
InChIKeyKSYDAVXGPLUMLR-UHFFFAOYSA-N
XLogP3.51
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.20
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(4-acetylphenoxy)-N-(2-iodophenyl)acetamide 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

2-(4-acetamidophenoxy)-N-(2-iodophenyl)acetamide
CID 7203363
2-(4-acetylphenoxy)-N-[2-(2-chlorophenoxy)phenyl]acetamide
CID 26764312
3-[2-(2-iodoanilino)-2-oxoethoxy]benzoic acid
CID 43215098
2-(4-chloro-3,5-dimethylphenoxy)-N-(2-iodophenyl)acetamide
CID 1329877
[2-(2-methylsulfonylanilino)-2-oxoethyl] 2-(4-acetylphenoxy)acetate
CID 8638261
2-(4-acetylphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide
CID 26905349
N-(2-acetamidophenyl)-2-(4-chlorophenoxy)acetamide
CID 113093665
N-(2-iodophenyl)-2-propan-2-yloxyacetamide
CID 47416512
2-(2-tert-butylphenoxy)-N-(2-iodophenyl)acetamide
CID 36678366
methyl 2-[2-(2-iodoanilino)-2-oxoethoxy]benzoate
CID 7763964
N-(2-iodophenyl)-2-(2-propan-2-ylphenoxy)acetamide
CID 7900625
N-(2-iodophenyl)-2-(2-oxochromen-7-yl)oxyacetamide
CID 2667413

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetylphenoxy)-N-(2-iodophenyl)acetamide?
The IUPAC name of 2-(4-acetylphenoxy)-N-(2-iodophenyl)acetamide (CID 2621387) is 2-(4-acetylphenoxy)-N-(2-iodophenyl)acetamide.
What is the SMILES notation for 2-(4-acetylphenoxy)-N-(2-iodophenyl)acetamide?
The canonical SMILES for 2-(4-acetylphenoxy)-N-(2-iodophenyl)acetamide is CC(=O)c1ccc(OCC(=O)Nc2ccccc2I)cc1.
What is the InChIKey of 2-(4-acetylphenoxy)-N-(2-iodophenyl)acetamide?
The InChIKey is KSYDAVXGPLUMLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14INO3/c1-11(19)12-6-8-13(9-7-12)21-10-16(20)18-15-5-3-2-4-14(15)17/h2-9H,10H2,1H3,(H,18,20).
What are the key properties of 2-(4-acetylphenoxy)-N-(2-iodophenyl)acetamide?
2-(4-acetylphenoxy)-N-(2-iodophenyl)acetamide has a molecular weight of 395.20 g/mol, XLogP of 3.51, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetylphenoxy)-N-(2-iodophenyl)acetamide is sourced from PubChem (CID 2621387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).