N-[4-(4-acetamidophenyl)sulfonylphenyl]decanamide

C24H32N2O4S — CID 3028150

IUPACN-[4-(4-acetamidophenyl)sulfonylphenyl]decanamide
SMILESCCCCCCCCCC(=O)Nc1ccc(S(=O)(=O)c2ccc(NC(C)=O)cc2)cc1
InChIInChI=1S/C24H32N2O4S/c1-3-4-5-6-7-8-9-10-24(28)26-21-13-17-23(18-14-21)31(29,30)22-15-11-20(12-16-22)25-19(2)27/h11-18H,3-10H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyUWAYYMMXWGODAS-UHFFFAOYSA-N
MW444.60 g/mol
LogP5.56
Rot. Bonds12

About N-[4-(4-acetamidophenyl)sulfonylphenyl]decanamide

N-[4-(4-acetamidophenyl)sulfonylphenyl]decanamide (PubChem CID 3028150) has the molecular formula C24H32N2O4S and a molecular weight of 444.60 g/mol. Its IUPAC name is N-[4-(4-acetamidophenyl)sulfonylphenyl]decanamide.

Molecular Properties

Compound NameN-[4-(4-acetamidophenyl)sulfonylphenyl]decanamide
PubChem CID3028150
Molecular FormulaC24H32N2O4S
Molecular Weight444.60 g/mol
Exact Mass444.21
IUPAC NameN-[4-(4-acetamidophenyl)sulfonylphenyl]decanamide
SMILESCCCCCCCCCC(=O)Nc1ccc(S(=O)(=O)c2ccc(NC(C)=O)cc2)cc1
InChIInChI=1S/C24H32N2O4S/c1-3-4-5-6-7-8-9-10-24(28)26-21-13-17-23(18-14-21)31(29,30)22-15-11-20(12-16-22)25-19(2)27/h11-18H,3-10H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyUWAYYMMXWGODAS-UHFFFAOYSA-N
XLogP5.56
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500444.60
LogP ≤ 55.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(4-acetamidophenyl)hexanamide
CID 4953736
N-[4-(4-nitrophenyl)sulfonylphenyl]heptanamide
CID 46707517
N-[4-(icosanoylamino)phenyl]icosanamide
CID 101291044
N,N'-bis[4-(acetylsulfamoyl)phenyl]hexanediamide
CID 3474503
N,N'-bis[(4-acetamidophenyl)sulfonyl]heptanediamide
CID 102513773
N-(4-chlorophenyl)tridecanamide
CID 4195215
N,N'-bis[4-(dipropylsulfamoyl)phenyl]decanediamide
CID 17080128
N-phenylheptatetracontanamide
CID 150503307
N-phenylpentacosanamide
CID 19025260
N-(4-hydroxyphenyl)-6-(2-octadecanoylhydrazinyl)-6-oxohexanamide
CID 139759322
N-[4-[2-[4-(dodecanoylamino)phenyl]ethynyl]phenyl]dodecanamide
CID 102416980
N-[4-[4-(heptanoylamino)phenoxy]phenyl]heptanamide
CID 3351099

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-acetamidophenyl)sulfonylphenyl]decanamide?
The IUPAC name of N-[4-(4-acetamidophenyl)sulfonylphenyl]decanamide (CID 3028150) is N-[4-(4-acetamidophenyl)sulfonylphenyl]decanamide.
What is the SMILES notation for N-[4-(4-acetamidophenyl)sulfonylphenyl]decanamide?
The canonical SMILES for N-[4-(4-acetamidophenyl)sulfonylphenyl]decanamide is CCCCCCCCCC(=O)Nc1ccc(S(=O)(=O)c2ccc(NC(C)=O)cc2)cc1.
What is the InChIKey of N-[4-(4-acetamidophenyl)sulfonylphenyl]decanamide?
The InChIKey is UWAYYMMXWGODAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N2O4S/c1-3-4-5-6-7-8-9-10-24(28)26-21-13-17-23(18-14-21)31(29,30)22-15-11-20(12-16-22)25-19(2)27/h11-18H,3-10H2,1-2H3,(H,25,27)(H,26,28).
What are the key properties of N-[4-(4-acetamidophenyl)sulfonylphenyl]decanamide?
N-[4-(4-acetamidophenyl)sulfonylphenyl]decanamide has a molecular weight of 444.60 g/mol, XLogP of 5.56, 12 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-acetamidophenyl)sulfonylphenyl]decanamide is sourced from PubChem (CID 3028150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).