N-[4-(4-aminophenyl)sulfonylphenyl]acetamide

C14H14N2O3S — CID 11257

IUPACN-[4-(4-aminophenyl)sulfonylphenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1
InChIInChI=1S/C14H14N2O3S/c1-10(17)16-12-4-8-14(9-5-12)20(18,19)13-6-2-11(15)3-7-13/h2-9H,15H2,1H3,(H,16,17)
InChIKeyWDOCBIHNYYQINH-UHFFFAOYSA-N
MW290.34 g/mol
LogP2.06
Rot. Bonds3

About N-[4-(4-aminophenyl)sulfonylphenyl]acetamide

N-[4-(4-aminophenyl)sulfonylphenyl]acetamide (PubChem CID 11257) has the molecular formula C14H14N2O3S and a molecular weight of 290.34 g/mol. Its IUPAC name is N-[4-(4-aminophenyl)sulfonylphenyl]acetamide.

Molecular Properties

Compound NameN-[4-(4-aminophenyl)sulfonylphenyl]acetamide
PubChem CID11257
Molecular FormulaC14H14N2O3S
Molecular Weight290.34 g/mol
Exact Mass290.07
IUPAC NameN-[4-(4-aminophenyl)sulfonylphenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1
InChIInChI=1S/C14H14N2O3S/c1-10(17)16-12-4-8-14(9-5-12)20(18,19)13-6-2-11(15)3-7-13/h2-9H,15H2,1H3,(H,16,17)
InChIKeyWDOCBIHNYYQINH-UHFFFAOYSA-N
XLogP2.06
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.34
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

Dapsone
CID 2955
N4-Acetylsulfanilamide
CID 8482
Acedapsone
CID 6477
N-Acetylsulfanilyl chloride
CID 8481
Sulfanitran
CID 5334
Carbamic acid, [[4-(acetylamino)phenyl]sulfonyl]-, methyl ester
CID 607662
Acediasulfone
CID 66451
N-[4-(hydroxysulfamoyl)phenyl]acetamide
CID 283995
4-[(Anilinocarbonyl)amino]benzenesulfonamide
CID 306924
4'-Mercaptoacetanilide
CID 70777
Succisulfone
CID 68350
2-cyano-N-(4-sulfamoylphenyl)acetamide
CID 2357187

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-aminophenyl)sulfonylphenyl]acetamide?
The IUPAC name of N-[4-(4-aminophenyl)sulfonylphenyl]acetamide (CID 11257) is N-[4-(4-aminophenyl)sulfonylphenyl]acetamide.
What is the SMILES notation for N-[4-(4-aminophenyl)sulfonylphenyl]acetamide?
The canonical SMILES for N-[4-(4-aminophenyl)sulfonylphenyl]acetamide is CC(=O)Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1.
What is the InChIKey of N-[4-(4-aminophenyl)sulfonylphenyl]acetamide?
The InChIKey is WDOCBIHNYYQINH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3S/c1-10(17)16-12-4-8-14(9-5-12)20(18,19)13-6-2-11(15)3-7-13/h2-9H,15H2,1H3,(H,16,17).
What are the key properties of N-[4-(4-aminophenyl)sulfonylphenyl]acetamide?
N-[4-(4-aminophenyl)sulfonylphenyl]acetamide has a molecular weight of 290.34 g/mol, XLogP of 2.06, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-aminophenyl)sulfonylphenyl]acetamide is sourced from PubChem (CID 11257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).