N-butyl-4-(phenylsulfamoyl)benzamide

C17H20N2O3S — CID 18106255

IUPACN-butyl-4-(phenylsulfamoyl)benzamide
SMILESCCCCNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1
InChIInChI=1S/C17H20N2O3S/c1-2-3-13-18-17(20)14-9-11-16(12-10-14)23(21,22)19-15-7-5-4-6-8-15/h4-12,19H,2-3,13H2,1H3,(H,18,20)
InChIKeyUEDPUZLUUIRRCO-UHFFFAOYSA-N
MW332.43 g/mol
LogP3.02
Rot. Bonds7

About N-butyl-4-(phenylsulfamoyl)benzamide

N-butyl-4-(phenylsulfamoyl)benzamide (PubChem CID 18106255) has the molecular formula C17H20N2O3S and a molecular weight of 332.43 g/mol. Its IUPAC name is N-butyl-4-(phenylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-butyl-4-(phenylsulfamoyl)benzamide
PubChem CID18106255
Molecular FormulaC17H20N2O3S
Molecular Weight332.43 g/mol
Exact Mass332.12
IUPAC NameN-butyl-4-(phenylsulfamoyl)benzamide
SMILESCCCCNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1
InChIInChI=1S/C17H20N2O3S/c1-2-3-13-18-17(20)14-9-11-16(12-10-14)23(21,22)19-15-7-5-4-6-8-15/h4-12,19H,2-3,13H2,1H3,(H,18,20)
InChIKeyUEDPUZLUUIRRCO-UHFFFAOYSA-N
XLogP3.02
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 ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-butyl-4-(phenylsulfamoyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-hexyl-4-(phenylsulfamoyl)benzamide
CID 32646547
N-butyl-4-[(4-ethylphenyl)sulfamoyl]benzamide
CID 109058620
4-[(3-methylphenyl)sulfamoyl]-N-pentylbenzamide
CID 109061330
N-butyl-4-(pentylsulfamoyl)benzamide
CID 109058608
N-butyl-4-[(2,3-dimethylphenyl)sulfamoyl]benzamide
CID 9414249
N-(3-butoxypropyl)-4-[(4-fluorophenyl)sulfonylamino]benzamide
CID 27683058
4-(butylsulfamoyl)-N-(2-phenylethyl)benzamide
CID 109058705
4-[(3,4-dichlorophenyl)sulfonylamino]-N-pentylbenzamide
CID 18279871
4-(1,3-benzodioxol-5-ylsulfamoyl)-N-butylbenzamide
CID 109058656
4-butanoyl-N-phenylbenzenesulfonamide
CID 82164605
4-chloro-N-pentyl-3-(phenylsulfamoyl)benzamide
CID 126415696
N-butyl-4-phenylbenzamide
CID 3637649

Frequently Asked Questions

What is the IUPAC name of N-butyl-4-(phenylsulfamoyl)benzamide?
The IUPAC name of N-butyl-4-(phenylsulfamoyl)benzamide (CID 18106255) is N-butyl-4-(phenylsulfamoyl)benzamide.
What is the SMILES notation for N-butyl-4-(phenylsulfamoyl)benzamide?
The canonical SMILES for N-butyl-4-(phenylsulfamoyl)benzamide is CCCCNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1.
What is the InChIKey of N-butyl-4-(phenylsulfamoyl)benzamide?
The InChIKey is UEDPUZLUUIRRCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3S/c1-2-3-13-18-17(20)14-9-11-16(12-10-14)23(21,22)19-15-7-5-4-6-8-15/h4-12,19H,2-3,13H2,1H3,(H,18,20).
What are the key properties of N-butyl-4-(phenylsulfamoyl)benzamide?
N-butyl-4-(phenylsulfamoyl)benzamide has a molecular weight of 332.43 g/mol, XLogP of 3.02, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-4-(phenylsulfamoyl)benzamide is sourced from PubChem (CID 18106255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).