N-(2-iodophenyl)-1-(methylamino)propane-2-sulfonamide

C10H15IN2O2S — CID 106030243

IUPACN-(2-iodophenyl)-1-(methylamino)propane-2-sulfonamide
SMILESCNCC(C)S(=O)(=O)Nc1ccccc1I
InChIInChI=1S/C10H15IN2O2S/c1-8(7-12-2)16(14,15)13-10-6-4-3-5-9(10)11/h3-6,8,12-13H,7H2,1-2H3
InChIKeyVYAZOCKUUOYIDY-UHFFFAOYSA-N
MW354.21 g/mol
LogP1.64
Rot. Bonds5

About N-(2-iodophenyl)-1-(methylamino)propane-2-sulfonamide

N-(2-iodophenyl)-1-(methylamino)propane-2-sulfonamide (PubChem CID 106030243) has the molecular formula C10H15IN2O2S and a molecular weight of 354.21 g/mol. Its IUPAC name is N-(2-iodophenyl)-1-(methylamino)propane-2-sulfonamide.

Molecular Properties

Compound NameN-(2-iodophenyl)-1-(methylamino)propane-2-sulfonamide
PubChem CID106030243
Molecular FormulaC10H15IN2O2S
Molecular Weight354.21 g/mol
Exact Mass353.99
IUPAC NameN-(2-iodophenyl)-1-(methylamino)propane-2-sulfonamide
SMILESCNCC(C)S(=O)(=O)Nc1ccccc1I
InChIInChI=1S/C10H15IN2O2S/c1-8(7-12-2)16(14,15)13-10-6-4-3-5-9(10)11/h3-6,8,12-13H,7H2,1-2H3
InChIKeyVYAZOCKUUOYIDY-UHFFFAOYSA-N
XLogP1.64
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.21
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(2-iodophenyl)-1-(methylamino)propane-2-sulfonamide 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-(2,3-dichlorophenyl)-1-(methylamino)propane-2-sulfonamide
CID 106030674
N-(3-fluoro-2-methylphenyl)-1-(methylamino)propane-2-sulfonamide
CID 106018428
N-(2-iodophenyl)ethanesulfonamide
CID 6468386
N-(2-iodophenyl)sulfamoyl iodide
CID 155206328
N-(4-bromo-2-ethylphenyl)-1-(methylamino)propane-2-sulfonamide
CID 114141749
N-(2-bromophenyl)-1-(propan-2-ylamino)propane-2-sulfonamide
CID 106061222
N-(2-iodophenyl)-1-[4-(methylaminomethyl)phenyl]methanesulfonamide
CID 106030313
N-(3-fluorophenyl)-1-(methylamino)propane-2-sulfonamide
CID 106060646
1-(methylamino)-N-thiophen-3-ylpropane-2-sulfonamide
CID 106070014
N-(3-ethyl-1-methylpyrazol-4-yl)-1-(methylamino)propane-2-sulfonamide
CID 106090358
1-(methylamino)-N-(2,3,4,5,6-pentafluorophenyl)propane-2-sulfonamide
CID 106074521
1-(methylamino)-N-(2,3,5,6-tetrafluorophenyl)propane-2-sulfonamide
CID 106087564

Frequently Asked Questions

What is the IUPAC name of N-(2-iodophenyl)-1-(methylamino)propane-2-sulfonamide?
The IUPAC name of N-(2-iodophenyl)-1-(methylamino)propane-2-sulfonamide (CID 106030243) is N-(2-iodophenyl)-1-(methylamino)propane-2-sulfonamide.
What is the SMILES notation for N-(2-iodophenyl)-1-(methylamino)propane-2-sulfonamide?
The canonical SMILES for N-(2-iodophenyl)-1-(methylamino)propane-2-sulfonamide is CNCC(C)S(=O)(=O)Nc1ccccc1I.
What is the InChIKey of N-(2-iodophenyl)-1-(methylamino)propane-2-sulfonamide?
The InChIKey is VYAZOCKUUOYIDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15IN2O2S/c1-8(7-12-2)16(14,15)13-10-6-4-3-5-9(10)11/h3-6,8,12-13H,7H2,1-2H3.
What are the key properties of N-(2-iodophenyl)-1-(methylamino)propane-2-sulfonamide?
N-(2-iodophenyl)-1-(methylamino)propane-2-sulfonamide has a molecular weight of 354.21 g/mol, XLogP of 1.64, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-iodophenyl)-1-(methylamino)propane-2-sulfonamide is sourced from PubChem (CID 106030243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).