4-[2-(cyclohexen-1-yl)ethylsulfamoyl]-N-phenylbenzamide

C21H24N2O3S — CID 109059673

IUPAC4-[2-(cyclohexen-1-yl)ethylsulfamoyl]-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1ccc(S(=O)(=O)NCCC2=CCCCC2)cc1
InChIInChI=1S/C21H24N2O3S/c24-21(23-19-9-5-2-6-10-19)18-11-13-20(14-12-18)27(25,26)22-16-15-17-7-3-1-4-8-17/h2,5-7,9-14,22H,1,3-4,8,15-16H2,(H,23,24)
InChIKeyGFALILJOSVHYMI-UHFFFAOYSA-N
MW384.50 g/mol
LogP4.11
Rot. Bonds7

About 4-[2-(cyclohexen-1-yl)ethylsulfamoyl]-N-phenylbenzamide

4-[2-(cyclohexen-1-yl)ethylsulfamoyl]-N-phenylbenzamide (PubChem CID 109059673) has the molecular formula C21H24N2O3S and a molecular weight of 384.50 g/mol. Its IUPAC name is 4-[2-(cyclohexen-1-yl)ethylsulfamoyl]-N-phenylbenzamide.

Molecular Properties

Compound Name4-[2-(cyclohexen-1-yl)ethylsulfamoyl]-N-phenylbenzamide
PubChem CID109059673
Molecular FormulaC21H24N2O3S
Molecular Weight384.50 g/mol
Exact Mass384.15
IUPAC Name4-[2-(cyclohexen-1-yl)ethylsulfamoyl]-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1ccc(S(=O)(=O)NCCC2=CCCCC2)cc1
InChIInChI=1S/C21H24N2O3S/c24-21(23-19-9-5-2-6-10-19)18-11-13-20(14-12-18)27(25,26)22-16-15-17-7-3-1-4-8-17/h2,5-7,9-14,22H,1,3-4,8,15-16H2,(H,23,24)
InChIKeyGFALILJOSVHYMI-UHFFFAOYSA-N
XLogP4.11
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.50
LogP ≤ 54.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 4-[2-(cyclohexen-1-yl)ethylsulfamoyl]-N-phenylbenzamide 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

4-[2-(cyclohexen-1-yl)ethylsulfamoyl]-N-cyclopropylbenzamide
CID 109058268
4-(benzylsulfamoyl)-N-[2-(cyclohexen-1-yl)ethyl]benzamide
CID 109059643
N-[2-(cyclohexen-1-yl)ethyl]-4-(2-methoxyethylsulfamoyl)benzamide
CID 38105049
3-[2-(cyclohexen-1-yl)ethylsulfamoyl]benzoic acid
CID 43091539
4-[2-(4-fluorophenyl)ethylsulfamoyl]-N-phenylbenzamide
CID 109061048
4-[2-(cyclohexen-1-yl)ethylsulfamoyl]-N-[3-(dimethylamino)propyl]benzamide
CID 109059659
2-(benzenesulfonamido)-N-[2-(cyclohexen-1-yl)ethyl]acetamide
CID 112991103
N-[2-(cyclohexen-1-yl)ethyl]-4-(pyridin-2-ylmethylsulfamoyl)benzamide
CID 109059644
N-[[4-[2-(cyclohexen-1-yl)ethylsulfamoyl]phenyl]methyl]acetamide
CID 31481407
5-[2-(cyclohexen-1-yl)ethylsulfamoyl]-2-(2-phenylethylamino)benzoic acid
CID 99983404
4-(ethylsulfamoyl)-N-phenylbenzamide
CID 1262046
4-N-(4-acetylphenyl)-1-N-[2-(cyclohexen-1-yl)ethyl]benzene-1,4-dicarboxamide
CID 109045058

Frequently Asked Questions

What is the IUPAC name of 4-[2-(cyclohexen-1-yl)ethylsulfamoyl]-N-phenylbenzamide?
The IUPAC name of 4-[2-(cyclohexen-1-yl)ethylsulfamoyl]-N-phenylbenzamide (CID 109059673) is 4-[2-(cyclohexen-1-yl)ethylsulfamoyl]-N-phenylbenzamide.
What is the SMILES notation for 4-[2-(cyclohexen-1-yl)ethylsulfamoyl]-N-phenylbenzamide?
The canonical SMILES for 4-[2-(cyclohexen-1-yl)ethylsulfamoyl]-N-phenylbenzamide is O=C(Nc1ccccc1)c1ccc(S(=O)(=O)NCCC2=CCCCC2)cc1.
What is the InChIKey of 4-[2-(cyclohexen-1-yl)ethylsulfamoyl]-N-phenylbenzamide?
The InChIKey is GFALILJOSVHYMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O3S/c24-21(23-19-9-5-2-6-10-19)18-11-13-20(14-12-18)27(25,26)22-16-15-17-7-3-1-4-8-17/h2,5-7,9-14,22H,1,3-4,8,15-16H2,(H,23,24).
What are the key properties of 4-[2-(cyclohexen-1-yl)ethylsulfamoyl]-N-phenylbenzamide?
4-[2-(cyclohexen-1-yl)ethylsulfamoyl]-N-phenylbenzamide has a molecular weight of 384.50 g/mol, XLogP of 4.11, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(cyclohexen-1-yl)ethylsulfamoyl]-N-phenylbenzamide is sourced from PubChem (CID 109059673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).