N-(2-iodophenyl)benzenesulfonamide

C12H10INO2S — CID 632219

IUPACN-(2-iodophenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccccc1I)c1ccccc1
InChIInChI=1S/C12H10INO2S/c13-11-8-4-5-9-12(11)14-17(15,16)10-6-2-1-3-7-10/h1-9,14H
InChIKeyJQTVJAXMBVZFOW-UHFFFAOYSA-N
MW359.19 g/mol
LogP3.09
Rot. Bonds3

About N-(2-iodophenyl)benzenesulfonamide

N-(2-iodophenyl)benzenesulfonamide (PubChem CID 632219) has the molecular formula C12H10INO2S and a molecular weight of 359.19 g/mol. Its IUPAC name is N-(2-iodophenyl)benzenesulfonamide.

Molecular Properties

Compound NameN-(2-iodophenyl)benzenesulfonamide
PubChem CID632219
Molecular FormulaC12H10INO2S
Molecular Weight359.19 g/mol
Exact Mass358.95
IUPAC NameN-(2-iodophenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccccc1I)c1ccccc1
InChIInChI=1S/C12H10INO2S/c13-11-8-4-5-9-12(11)14-17(15,16)10-6-2-1-3-7-10/h1-9,14H
InChIKeyJQTVJAXMBVZFOW-UHFFFAOYSA-N
XLogP3.09
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.19
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-amino-N-(2-iodophenyl)benzenesulfonamide
CID 43124659
N-(2-iodophenyl)-3-methylbenzenesulfonamide
CID 47104358
4-[(2-iodophenyl)sulfamoyl]-N-methylbenzamide
CID 26781170
N-(2-iodophenyl)-4-(trifluoromethoxy)benzenesulfonamide
CID 26952500
3-cyano-N-(2-iodophenyl)benzenesulfonamide
CID 7938667
4-(cyanomethyl)-N-(2-iodophenyl)benzenesulfonamide
CID 79185029
N-[5-(benzenesulfonamido)naphthalen-1-yl]benzenesulfonamide
CID 3389796
N-(2-iodophenyl)sulfamoyl iodide
CID 155206328
3-[(2-iodophenyl)sulfamoyl]benzenecarbothioamide
CID 28978447
methyl 3-[(2-iodophenyl)sulfamoyl]benzoate
CID 31699712
2-amino-N-(2-iodophenyl)benzenesulfonamide
CID 43124657
4-(benzenesulfonamido)-N-phenylbenzenesulfonamide
CID 1333712

Frequently Asked Questions

What is the IUPAC name of N-(2-iodophenyl)benzenesulfonamide?
The IUPAC name of N-(2-iodophenyl)benzenesulfonamide (CID 632219) is N-(2-iodophenyl)benzenesulfonamide.
What is the SMILES notation for N-(2-iodophenyl)benzenesulfonamide?
The canonical SMILES for N-(2-iodophenyl)benzenesulfonamide is O=S(=O)(Nc1ccccc1I)c1ccccc1.
What is the InChIKey of N-(2-iodophenyl)benzenesulfonamide?
The InChIKey is JQTVJAXMBVZFOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10INO2S/c13-11-8-4-5-9-12(11)14-17(15,16)10-6-2-1-3-7-10/h1-9,14H.
What are the key properties of N-(2-iodophenyl)benzenesulfonamide?
N-(2-iodophenyl)benzenesulfonamide has a molecular weight of 359.19 g/mol, XLogP of 3.09, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-iodophenyl)benzenesulfonamide is sourced from PubChem (CID 632219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).