4-(cycloheptylsulfamoyl)-N-(4-fluorophenyl)benzamide

C20H23FN2O3S — CID 109061223

IUPAC4-(cycloheptylsulfamoyl)-N-(4-fluorophenyl)benzamide
SMILESO=C(Nc1ccc(F)cc1)c1ccc(S(=O)(=O)NC2CCCCCC2)cc1
InChIInChI=1S/C20H23FN2O3S/c21-16-9-11-17(12-10-16)22-20(24)15-7-13-19(14-8-15)27(25,26)23-18-5-3-1-2-4-6-18/h7-14,18,23H,1-6H2,(H,22,24)
InChIKeyHYAHBVASTOCPET-UHFFFAOYSA-N
MW390.48 g/mol
LogP4.08
Rot. Bonds5

About 4-(cycloheptylsulfamoyl)-N-(4-fluorophenyl)benzamide

4-(cycloheptylsulfamoyl)-N-(4-fluorophenyl)benzamide (PubChem CID 109061223) has the molecular formula C20H23FN2O3S and a molecular weight of 390.48 g/mol. Its IUPAC name is 4-(cycloheptylsulfamoyl)-N-(4-fluorophenyl)benzamide.

Molecular Properties

Compound Name4-(cycloheptylsulfamoyl)-N-(4-fluorophenyl)benzamide
PubChem CID109061223
Molecular FormulaC20H23FN2O3S
Molecular Weight390.48 g/mol
Exact Mass390.14
IUPAC Name4-(cycloheptylsulfamoyl)-N-(4-fluorophenyl)benzamide
SMILESO=C(Nc1ccc(F)cc1)c1ccc(S(=O)(=O)NC2CCCCCC2)cc1
InChIInChI=1S/C20H23FN2O3S/c21-16-9-11-17(12-10-16)22-20(24)15-7-13-19(14-8-15)27(25,26)23-18-5-3-1-2-4-6-18/h7-14,18,23H,1-6H2,(H,22,24)
InChIKeyHYAHBVASTOCPET-UHFFFAOYSA-N
XLogP4.08
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.48
LogP ≤ 54.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]-4-fluorobenzamide
CID 1015213
N-[4-(cyclohexylsulfamoyl)phenyl]-4-(4-fluorophenyl)-4-oxobutanamide
CID 108807070
5-(cyclohexylsulfamoyl)-2-fluoro-N-(4-fluorophenyl)benzamide
CID 118285426
4-(cyclopentylsulfamoyl)-N-(4-ethylphenyl)benzamide
CID 109059369
N-[4-(cyclohexylsulfamoyl)phenyl]-4-(prop-2-enylsulfamoyl)benzamide
CID 19258102
N-(4-acetamidophenyl)-4-(cyclopropylsulfamoyl)benzamide
CID 30683390
N-[4-(cyclohexylsulfamoyl)phenyl]-4-(2-methoxyethoxy)benzamide
CID 17353443
4-(cyclopropylsulfamoyl)-N-[4-(trifluoromethyl)phenyl]benzamide
CID 26701623
3-[4-(cyclohexylsulfamoyl)phenyl]-N-(4-fluorophenyl)propanamide
CID 126248632
N-[4-(cyclohexylsulfamoyl)phenyl]-3-(4-fluorophenyl)prop-2-enamide
CID 3456876
N-[4-(cyclopentylsulfamoyl)phenyl]-5-fluoro-2-methylbenzamide
CID 119045157
N-(4-cyclopentyloxyphenyl)-4-(cyclopropylsulfamoyl)benzamide
CID 36566720

Frequently Asked Questions

What is the IUPAC name of 4-(cycloheptylsulfamoyl)-N-(4-fluorophenyl)benzamide?
The IUPAC name of 4-(cycloheptylsulfamoyl)-N-(4-fluorophenyl)benzamide (CID 109061223) is 4-(cycloheptylsulfamoyl)-N-(4-fluorophenyl)benzamide.
What is the SMILES notation for 4-(cycloheptylsulfamoyl)-N-(4-fluorophenyl)benzamide?
The canonical SMILES for 4-(cycloheptylsulfamoyl)-N-(4-fluorophenyl)benzamide is O=C(Nc1ccc(F)cc1)c1ccc(S(=O)(=O)NC2CCCCCC2)cc1.
What is the InChIKey of 4-(cycloheptylsulfamoyl)-N-(4-fluorophenyl)benzamide?
The InChIKey is HYAHBVASTOCPET-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23FN2O3S/c21-16-9-11-17(12-10-16)22-20(24)15-7-13-19(14-8-15)27(25,26)23-18-5-3-1-2-4-6-18/h7-14,18,23H,1-6H2,(H,22,24).
What are the key properties of 4-(cycloheptylsulfamoyl)-N-(4-fluorophenyl)benzamide?
4-(cycloheptylsulfamoyl)-N-(4-fluorophenyl)benzamide has a molecular weight of 390.48 g/mol, XLogP of 4.08, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cycloheptylsulfamoyl)-N-(4-fluorophenyl)benzamide is sourced from PubChem (CID 109061223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).