N-[4-(benzylsulfamoyl)phenyl]cyclohexanecarboxamide

C20H24N2O3S — CID 2987452

IUPACN-[4-(benzylsulfamoyl)phenyl]cyclohexanecarboxamide
SMILESO=C(Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1)C1CCCCC1
InChIInChI=1S/C20H24N2O3S/c23-20(17-9-5-2-6-10-17)22-18-11-13-19(14-12-18)26(24,25)21-15-16-7-3-1-4-8-16/h1,3-4,7-8,11-14,17,21H,2,5-6,9-10,15H2,(H,22,23)
InChIKeyTYPXAMOFUOOCFV-UHFFFAOYSA-N
MW372.49 g/mol
LogP3.68
Rot. Bonds6

About N-[4-(benzylsulfamoyl)phenyl]cyclohexanecarboxamide

N-[4-(benzylsulfamoyl)phenyl]cyclohexanecarboxamide (PubChem CID 2987452) has the molecular formula C20H24N2O3S and a molecular weight of 372.49 g/mol. Its IUPAC name is N-[4-(benzylsulfamoyl)phenyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[4-(benzylsulfamoyl)phenyl]cyclohexanecarboxamide
PubChem CID2987452
Molecular FormulaC20H24N2O3S
Molecular Weight372.49 g/mol
Exact Mass372.15
IUPAC NameN-[4-(benzylsulfamoyl)phenyl]cyclohexanecarboxamide
SMILESO=C(Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1)C1CCCCC1
InChIInChI=1S/C20H24N2O3S/c23-20(17-9-5-2-6-10-17)22-18-11-13-19(14-12-18)26(24,25)21-15-16-7-3-1-4-8-16/h1,3-4,7-8,11-14,17,21H,2,5-6,9-10,15H2,(H,22,23)
InChIKeyTYPXAMOFUOOCFV-UHFFFAOYSA-N
XLogP3.68
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.49
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-acetyl-N-[4-(benzylsulfamoyl)phenyl]piperidine-4-carboxamide
CID 6470610
1-[4-(benzylsulfamoyl)phenyl]-3-phenylthiourea
CID 4928890
1-N,4-N-bis[4-(benzylsulfamoyl)phenyl]benzene-1,4-dicarboxamide
CID 4929117
tert-butyl 2-[[4-(cyclohexanecarbonylamino)phenyl]sulfonylamino]acetate
CID 22456406
N-[[4-(benzylsulfamoyl)phenyl]carbamothioyl]acetamide
CID 4929109
4-(benzenesulfonamidomethyl)-N-(4-chlorophenyl)cyclohexane-1-carboxamide
CID 11327244
N-[4-[4-(cyclobutanecarbonylamino)phenyl]sulfonylphenyl]cyclobutanecarboxamide
CID 9394899
N-[4-(methylaminomethyl)phenyl]cycloheptanecarboxamide
CID 106909905
N-[4-(benzenesulfonamidomethyl)phenyl]acetamide
CID 32683830
N-[4-(cyclopropanecarbonylamino)phenyl]cyclohexanecarboxamide
CID 25276011
N-[4-(3-methylbutanoylsulfamoyl)phenyl]cyclohexanecarboxamide
CID 1116699
N-[2-[(4-acetamidophenyl)sulfonylamino]ethyl]cyclohexanecarboxamide
CID 108571113

Frequently Asked Questions

What is the IUPAC name of N-[4-(benzylsulfamoyl)phenyl]cyclohexanecarboxamide?
The IUPAC name of N-[4-(benzylsulfamoyl)phenyl]cyclohexanecarboxamide (CID 2987452) is N-[4-(benzylsulfamoyl)phenyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[4-(benzylsulfamoyl)phenyl]cyclohexanecarboxamide?
The canonical SMILES for N-[4-(benzylsulfamoyl)phenyl]cyclohexanecarboxamide is O=C(Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1)C1CCCCC1.
What is the InChIKey of N-[4-(benzylsulfamoyl)phenyl]cyclohexanecarboxamide?
The InChIKey is TYPXAMOFUOOCFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3S/c23-20(17-9-5-2-6-10-17)22-18-11-13-19(14-12-18)26(24,25)21-15-16-7-3-1-4-8-16/h1,3-4,7-8,11-14,17,21H,2,5-6,9-10,15H2,(H,22,23).
What are the key properties of N-[4-(benzylsulfamoyl)phenyl]cyclohexanecarboxamide?
N-[4-(benzylsulfamoyl)phenyl]cyclohexanecarboxamide has a molecular weight of 372.49 g/mol, XLogP of 3.68, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(benzylsulfamoyl)phenyl]cyclohexanecarboxamide is sourced from PubChem (CID 2987452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).