N-(4-iodophenyl)-3-(4-sulfamoylphenyl)propanamide

C15H15IN2O3S — CID 24641005

IUPACN-(4-iodophenyl)-3-(4-sulfamoylphenyl)propanamide
SMILESNS(=O)(=O)c1ccc(CCC(=O)Nc2ccc(I)cc2)cc1
InChIInChI=1S/C15H15IN2O3S/c16-12-4-6-13(7-5-12)18-15(19)10-3-11-1-8-14(9-2-11)22(17,20)21/h1-2,4-9H,3,10H2,(H,18,19)(H2,17,20,21)
InChIKeySVNFEXQPQAQWHZ-UHFFFAOYSA-N
MW430.27 g/mol
LogP2.51
Rot. Bonds5

About N-(4-iodophenyl)-3-(4-sulfamoylphenyl)propanamide

N-(4-iodophenyl)-3-(4-sulfamoylphenyl)propanamide (PubChem CID 24641005) has the molecular formula C15H15IN2O3S and a molecular weight of 430.27 g/mol. Its IUPAC name is N-(4-iodophenyl)-3-(4-sulfamoylphenyl)propanamide.

Molecular Properties

Compound NameN-(4-iodophenyl)-3-(4-sulfamoylphenyl)propanamide
PubChem CID24641005
Molecular FormulaC15H15IN2O3S
Molecular Weight430.27 g/mol
Exact Mass429.98
IUPAC NameN-(4-iodophenyl)-3-(4-sulfamoylphenyl)propanamide
SMILESNS(=O)(=O)c1ccc(CCC(=O)Nc2ccc(I)cc2)cc1
InChIInChI=1S/C15H15IN2O3S/c16-12-4-6-13(7-5-12)18-15(19)10-3-11-1-8-14(9-2-11)22(17,20)21/h1-2,4-9H,3,10H2,(H,18,19)(H2,17,20,21)
InChIKeySVNFEXQPQAQWHZ-UHFFFAOYSA-N
XLogP2.51
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.27
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(4-propylphenyl)-3-(4-sulfamoylphenyl)propanamide
CID 24571120
3-(4-chlorophenyl)-N-(4-sulfamoylphenyl)propanamide
CID 19220922
3-(3,4-difluorophenyl)-N-(4-sulfamoylphenyl)propanamide
CID 160701153
N-[4-(4-methylphenoxy)phenyl]-3-(4-sulfamoylphenyl)propanamide
CID 24575363
3-(3-chloro-4-fluorophenyl)-N-(4-sulfamoylphenyl)propanamide
CID 147765273
3-amino-N-(4-sulfamoylphenyl)propanamide
CID 10776616
N-(4-ethylphenyl)-3-[2-(4-sulfamoylphenyl)ethylamino]propanamide
CID 109027692
N-(3-chlorophenyl)-3-(4-sulfamoylphenyl)propanamide
CID 24638907
N-(1,3-benzodioxol-5-yl)-3-(4-sulfamoylphenyl)propanamide
CID 27648509
N,N'-bis(4-iodophenyl)butanediamide
CID 4250378
N-ethyl-3-(4-sulfamoylphenyl)propanamide
CID 47109333
3-(furan-2-yl)-N-(4-sulfamoylphenyl)propanamide
CID 18863026

Frequently Asked Questions

What is the IUPAC name of N-(4-iodophenyl)-3-(4-sulfamoylphenyl)propanamide?
The IUPAC name of N-(4-iodophenyl)-3-(4-sulfamoylphenyl)propanamide (CID 24641005) is N-(4-iodophenyl)-3-(4-sulfamoylphenyl)propanamide.
What is the SMILES notation for N-(4-iodophenyl)-3-(4-sulfamoylphenyl)propanamide?
The canonical SMILES for N-(4-iodophenyl)-3-(4-sulfamoylphenyl)propanamide is NS(=O)(=O)c1ccc(CCC(=O)Nc2ccc(I)cc2)cc1.
What is the InChIKey of N-(4-iodophenyl)-3-(4-sulfamoylphenyl)propanamide?
The InChIKey is SVNFEXQPQAQWHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15IN2O3S/c16-12-4-6-13(7-5-12)18-15(19)10-3-11-1-8-14(9-2-11)22(17,20)21/h1-2,4-9H,3,10H2,(H,18,19)(H2,17,20,21).
What are the key properties of N-(4-iodophenyl)-3-(4-sulfamoylphenyl)propanamide?
N-(4-iodophenyl)-3-(4-sulfamoylphenyl)propanamide has a molecular weight of 430.27 g/mol, XLogP of 2.51, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-iodophenyl)-3-(4-sulfamoylphenyl)propanamide is sourced from PubChem (CID 24641005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).