2-(2-iodophenoxy)-N-(4-methyl-3-sulfamoylphenyl)acetamide

C15H15IN2O4S — CID 38879249

IUPAC2-(2-iodophenoxy)-N-(4-methyl-3-sulfamoylphenyl)acetamide
SMILESCc1ccc(NC(=O)COc2ccccc2I)cc1S(N)(=O)=O
InChIInChI=1S/C15H15IN2O4S/c1-10-6-7-11(8-14(10)23(17,20)21)18-15(19)9-22-13-5-3-2-4-12(13)16/h2-8H,9H2,1H3,(H,18,19)(H2,17,20,21)
InChIKeyAKWTZSCAQDZUNN-UHFFFAOYSA-N
MW446.27 g/mol
LogP2.26
Rot. Bonds5

About 2-(2-iodophenoxy)-N-(4-methyl-3-sulfamoylphenyl)acetamide

2-(2-iodophenoxy)-N-(4-methyl-3-sulfamoylphenyl)acetamide (PubChem CID 38879249) has the molecular formula C15H15IN2O4S and a molecular weight of 446.27 g/mol. Its IUPAC name is 2-(2-iodophenoxy)-N-(4-methyl-3-sulfamoylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-iodophenoxy)-N-(4-methyl-3-sulfamoylphenyl)acetamide
PubChem CID38879249
Molecular FormulaC15H15IN2O4S
Molecular Weight446.27 g/mol
Exact Mass445.98
IUPAC Name2-(2-iodophenoxy)-N-(4-methyl-3-sulfamoylphenyl)acetamide
SMILESCc1ccc(NC(=O)COc2ccccc2I)cc1S(N)(=O)=O
InChIInChI=1S/C15H15IN2O4S/c1-10-6-7-11(8-14(10)23(17,20)21)18-15(19)9-22-13-5-3-2-4-12(13)16/h2-8H,9H2,1H3,(H,18,19)(H2,17,20,21)
InChIKeyAKWTZSCAQDZUNN-UHFFFAOYSA-N
XLogP2.26
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500446.27
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(3-amino-4-chlorophenyl)-2-(2-iodophenoxy)acetamide
CID 43479671
2-(4-chloro-3-methylphenoxy)-N-(4-methyl-3-sulfamoylphenyl)acetamide
CID 9140969
N-(4-fluorophenyl)-2-(2-iodophenoxy)acetamide
CID 38878179
2-(2-tert-butylphenoxy)-N-(4-methoxy-3-sulfamoylphenyl)acetamide
CID 26782054
4-[[2-(2-iodophenoxy)acetyl]amino]benzamide
CID 38878336
N-(4-methyl-3-sulfamoylphenyl)-3-(2-phenylphenoxy)propanamide
CID 38736892
[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl] 2-phenoxypropanoate
CID 55366679
2-(2,3-dihydro-1H-inden-5-yloxy)-N-(4-methyl-3-sulfamoylphenyl)acetamide
CID 9141062
N-(4-methyl-3-sulfamoylphenyl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 87002433
N-(4-amino-2-methylphenyl)-2-(2-iodophenoxy)acetamide
CID 43479664
2-(2-cyanophenoxy)-N-(3-iodo-4-methylphenyl)acetamide
CID 8874271
[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl] 2-(benzenesulfonamido)propanoate
CID 55365933

Frequently Asked Questions

What is the IUPAC name of 2-(2-iodophenoxy)-N-(4-methyl-3-sulfamoylphenyl)acetamide?
The IUPAC name of 2-(2-iodophenoxy)-N-(4-methyl-3-sulfamoylphenyl)acetamide (CID 38879249) is 2-(2-iodophenoxy)-N-(4-methyl-3-sulfamoylphenyl)acetamide.
What is the SMILES notation for 2-(2-iodophenoxy)-N-(4-methyl-3-sulfamoylphenyl)acetamide?
The canonical SMILES for 2-(2-iodophenoxy)-N-(4-methyl-3-sulfamoylphenyl)acetamide is Cc1ccc(NC(=O)COc2ccccc2I)cc1S(N)(=O)=O.
What is the InChIKey of 2-(2-iodophenoxy)-N-(4-methyl-3-sulfamoylphenyl)acetamide?
The InChIKey is AKWTZSCAQDZUNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15IN2O4S/c1-10-6-7-11(8-14(10)23(17,20)21)18-15(19)9-22-13-5-3-2-4-12(13)16/h2-8H,9H2,1H3,(H,18,19)(H2,17,20,21).
What are the key properties of 2-(2-iodophenoxy)-N-(4-methyl-3-sulfamoylphenyl)acetamide?
2-(2-iodophenoxy)-N-(4-methyl-3-sulfamoylphenyl)acetamide has a molecular weight of 446.27 g/mol, XLogP of 2.26, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-iodophenoxy)-N-(4-methyl-3-sulfamoylphenyl)acetamide is sourced from PubChem (CID 38879249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).