N-[3-oxo-3-[4-(2-phenylethylsulfamoyl)anilino]propyl]benzamide

C24H25N3O4S — CID 17154573

IUPACN-[3-oxo-3-[4-(2-phenylethylsulfamoyl)anilino]propyl]benzamide
SMILESO=C(CCNC(=O)c1ccccc1)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1
InChIInChI=1S/C24H25N3O4S/c28-23(16-17-25-24(29)20-9-5-2-6-10-20)27-21-11-13-22(14-12-21)32(30,31)26-18-15-19-7-3-1-4-8-19/h1-14,26H,15-18H2,(H,25,29)(H,27,28)
InChIKeyYMLHCLBMHVQXRS-UHFFFAOYSA-N
MW451.55 g/mol
LogP2.97
Rot. Bonds10

About N-[3-oxo-3-[4-(2-phenylethylsulfamoyl)anilino]propyl]benzamide

N-[3-oxo-3-[4-(2-phenylethylsulfamoyl)anilino]propyl]benzamide (PubChem CID 17154573) has the molecular formula C24H25N3O4S and a molecular weight of 451.55 g/mol. Its IUPAC name is N-[3-oxo-3-[4-(2-phenylethylsulfamoyl)anilino]propyl]benzamide.

Molecular Properties

Compound NameN-[3-oxo-3-[4-(2-phenylethylsulfamoyl)anilino]propyl]benzamide
PubChem CID17154573
Molecular FormulaC24H25N3O4S
Molecular Weight451.55 g/mol
Exact Mass451.16
IUPAC NameN-[3-oxo-3-[4-(2-phenylethylsulfamoyl)anilino]propyl]benzamide
SMILESO=C(CCNC(=O)c1ccccc1)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1
InChIInChI=1S/C24H25N3O4S/c28-23(16-17-25-24(29)20-9-5-2-6-10-20)27-21-11-13-22(14-12-21)32(30,31)26-18-15-19-7-3-1-4-8-19/h1-14,26H,15-18H2,(H,25,29)(H,27,28)
InChIKeyYMLHCLBMHVQXRS-UHFFFAOYSA-N
XLogP2.97
TPSA104.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500451.55
LogP ≤ 52.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-oxo-4-phenyl-N-[4-(2-phenylethylsulfamoyl)phenyl]butanamide
CID 108807364
3-[(4-bromophenyl)sulfonylamino]-N-[4-(2-phenylethylsulfamoyl)phenyl]propanamide
CID 17192480
4-chloro-N-[4-(2-phenylethylsulfamoyl)phenyl]butanamide
CID 17160952
N-[3-(4-methylsulfonylanilino)-3-oxopropyl]benzamide
CID 26213288
2-cyano-N-[4-(2-phenylethylsulfamoyl)phenyl]acetamide
CID 168522081
N-[4-(2-phenylethylsulfamoyl)phenyl]heptanamide
CID 54790596
4-bromo-N-[4-(2-phenylethylsulfamoyl)phenyl]benzamide
CID 5049971
4-chloro-N-[4-(2-phenylethylsulfamoyl)phenyl]benzamide
CID 4110983
N-(2-phenylethyl)-4-(3-phenylpropanoylamino)benzamide
CID 1296529
4-tert-butyl-N-[4-(2-phenylethylsulfamoyl)phenyl]benzamide
CID 3595428
N-[3-oxo-3-[4-(oxolan-2-ylmethylsulfamoyl)anilino]propyl]benzamide
CID 17154597
2-phenoxy-N-[4-(2-phenylethylsulfamoyl)phenyl]acetamide
CID 5187425

Frequently Asked Questions

What is the IUPAC name of N-[3-oxo-3-[4-(2-phenylethylsulfamoyl)anilino]propyl]benzamide?
The IUPAC name of N-[3-oxo-3-[4-(2-phenylethylsulfamoyl)anilino]propyl]benzamide (CID 17154573) is N-[3-oxo-3-[4-(2-phenylethylsulfamoyl)anilino]propyl]benzamide.
What is the SMILES notation for N-[3-oxo-3-[4-(2-phenylethylsulfamoyl)anilino]propyl]benzamide?
The canonical SMILES for N-[3-oxo-3-[4-(2-phenylethylsulfamoyl)anilino]propyl]benzamide is O=C(CCNC(=O)c1ccccc1)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1.
What is the InChIKey of N-[3-oxo-3-[4-(2-phenylethylsulfamoyl)anilino]propyl]benzamide?
The InChIKey is YMLHCLBMHVQXRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O4S/c28-23(16-17-25-24(29)20-9-5-2-6-10-20)27-21-11-13-22(14-12-21)32(30,31)26-18-15-19-7-3-1-4-8-19/h1-14,26H,15-18H2,(H,25,29)(H,27,28).
What are the key properties of N-[3-oxo-3-[4-(2-phenylethylsulfamoyl)anilino]propyl]benzamide?
N-[3-oxo-3-[4-(2-phenylethylsulfamoyl)anilino]propyl]benzamide has a molecular weight of 451.55 g/mol, XLogP of 2.97, 10 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-oxo-3-[4-(2-phenylethylsulfamoyl)anilino]propyl]benzamide is sourced from PubChem (CID 17154573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).