4-(butylsulfamoyl)-N-(2-phenylethyl)benzamide

C19H24N2O3S — CID 109058705

IUPAC4-(butylsulfamoyl)-N-(2-phenylethyl)benzamide
SMILESCCCCNS(=O)(=O)c1ccc(C(=O)NCCc2ccccc2)cc1
InChIInChI=1S/C19H24N2O3S/c1-2-3-14-21-25(23,24)18-11-9-17(10-12-18)19(22)20-15-13-16-7-5-4-6-8-16/h4-12,21H,2-3,13-15H2,1H3,(H,20,22)
InChIKeyBBAFGGPLZDNNRT-UHFFFAOYSA-N
MW360.48 g/mol
LogP2.74
Rot. Bonds9

About 4-(butylsulfamoyl)-N-(2-phenylethyl)benzamide

4-(butylsulfamoyl)-N-(2-phenylethyl)benzamide (PubChem CID 109058705) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is 4-(butylsulfamoyl)-N-(2-phenylethyl)benzamide.

Molecular Properties

Compound Name4-(butylsulfamoyl)-N-(2-phenylethyl)benzamide
PubChem CID109058705
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC Name4-(butylsulfamoyl)-N-(2-phenylethyl)benzamide
SMILESCCCCNS(=O)(=O)c1ccc(C(=O)NCCc2ccccc2)cc1
InChIInChI=1S/C19H24N2O3S/c1-2-3-14-21-25(23,24)18-11-9-17(10-12-18)19(22)20-15-13-16-7-5-4-6-8-16/h4-12,21H,2-3,13-15H2,1H3,(H,20,22)
InChIKeyBBAFGGPLZDNNRT-UHFFFAOYSA-N
XLogP2.74
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 52.74
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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Related Compounds

4-(ethylsulfamoyl)-N-(2-phenylethyl)benzamide
CID 51160983
4-(butylsulfamoyl)-N-[2-(3-methoxyphenyl)ethyl]benzamide
CID 109058710
N-butyl-4-(pentylsulfamoyl)benzamide
CID 109058608
4-(methylsulfamoyl)-N-(2-phenylethyl)benzamide
CID 51218673
N-(3-methylbutyl)-4-(2-phenylethylsulfamoyl)benzamide
CID 109061010
N-[2-(2-fluorophenyl)ethyl]-4-(pentylsulfamoyl)benzamide
CID 109061034
N,N-diethyl-4-(2-phenylethylsulfamoyl)benzamide
CID 47952538
N-butyl-4-(phenylsulfamoyl)benzamide
CID 18106255
1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide
CID 984633
4-butoxy-N-[4-(2-phenylethylsulfamoyl)phenyl]benzamide
CID 4936114
4-(butylsulfamoyl)-N-[(4-chlorophenyl)methyl]benzamide
CID 109058697
N-(2-phenylethyl)-4-(pyridin-3-ylmethylsulfamoyl)benzamide
CID 109060926

Frequently Asked Questions

What is the IUPAC name of 4-(butylsulfamoyl)-N-(2-phenylethyl)benzamide?
The IUPAC name of 4-(butylsulfamoyl)-N-(2-phenylethyl)benzamide (CID 109058705) is 4-(butylsulfamoyl)-N-(2-phenylethyl)benzamide.
What is the SMILES notation for 4-(butylsulfamoyl)-N-(2-phenylethyl)benzamide?
The canonical SMILES for 4-(butylsulfamoyl)-N-(2-phenylethyl)benzamide is CCCCNS(=O)(=O)c1ccc(C(=O)NCCc2ccccc2)cc1.
What is the InChIKey of 4-(butylsulfamoyl)-N-(2-phenylethyl)benzamide?
The InChIKey is BBAFGGPLZDNNRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-2-3-14-21-25(23,24)18-11-9-17(10-12-18)19(22)20-15-13-16-7-5-4-6-8-16/h4-12,21H,2-3,13-15H2,1H3,(H,20,22).
What are the key properties of 4-(butylsulfamoyl)-N-(2-phenylethyl)benzamide?
4-(butylsulfamoyl)-N-(2-phenylethyl)benzamide has a molecular weight of 360.48 g/mol, XLogP of 2.74, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(butylsulfamoyl)-N-(2-phenylethyl)benzamide is sourced from PubChem (CID 109058705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).