N-[4-(3-phenylpropylsulfamoyl)phenyl]acetamide

C17H20N2O3S — CID 2164921

IUPACN-[4-(3-phenylpropylsulfamoyl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1
InChIInChI=1S/C17H20N2O3S/c1-14(20)19-16-9-11-17(12-10-16)23(21,22)18-13-5-8-15-6-3-2-4-7-15/h2-4,6-7,9-12,18H,5,8,13H2,1H3,(H,19,20)
InChIKeySSXAAUWZUUFPPS-UHFFFAOYSA-N
MW332.43 g/mol
LogP2.56
Rot. Bonds7

About N-[4-(3-phenylpropylsulfamoyl)phenyl]acetamide

N-[4-(3-phenylpropylsulfamoyl)phenyl]acetamide (PubChem CID 2164921) has the molecular formula C17H20N2O3S and a molecular weight of 332.43 g/mol. Its IUPAC name is N-[4-(3-phenylpropylsulfamoyl)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-(3-phenylpropylsulfamoyl)phenyl]acetamide
PubChem CID2164921
Molecular FormulaC17H20N2O3S
Molecular Weight332.43 g/mol
Exact Mass332.12
IUPAC NameN-[4-(3-phenylpropylsulfamoyl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1
InChIInChI=1S/C17H20N2O3S/c1-14(20)19-16-9-11-17(12-10-16)23(21,22)18-13-5-8-15-6-3-2-4-7-15/h2-4,6-7,9-12,18H,5,8,13H2,1H3,(H,19,20)
InChIKeySSXAAUWZUUFPPS-UHFFFAOYSA-N
XLogP2.56
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.43
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[4-(3-phenylpropylsulfamoyl)phenyl]acetamide?
The IUPAC name of N-[4-(3-phenylpropylsulfamoyl)phenyl]acetamide (CID 2164921) is N-[4-(3-phenylpropylsulfamoyl)phenyl]acetamide.
What is the SMILES notation for N-[4-(3-phenylpropylsulfamoyl)phenyl]acetamide?
The canonical SMILES for N-[4-(3-phenylpropylsulfamoyl)phenyl]acetamide is CC(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1.
What is the InChIKey of N-[4-(3-phenylpropylsulfamoyl)phenyl]acetamide?
The InChIKey is SSXAAUWZUUFPPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3S/c1-14(20)19-16-9-11-17(12-10-16)23(21,22)18-13-5-8-15-6-3-2-4-7-15/h2-4,6-7,9-12,18H,5,8,13H2,1H3,(H,19,20).
What are the key properties of N-[4-(3-phenylpropylsulfamoyl)phenyl]acetamide?
N-[4-(3-phenylpropylsulfamoyl)phenyl]acetamide has a molecular weight of 332.43 g/mol, XLogP of 2.56, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-phenylpropylsulfamoyl)phenyl]acetamide is sourced from PubChem (CID 2164921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).