5-(cyclopentylsulfamoyl)-N-(3,4-dimethylphenyl)-2-fluorobenzamide

C20H23FN2O3S — CID 4643786

IUPAC5-(cyclopentylsulfamoyl)-N-(3,4-dimethylphenyl)-2-fluorobenzamide
SMILESCc1ccc(NC(=O)c2cc(S(=O)(=O)NC3CCCC3)ccc2F)cc1C
InChIInChI=1S/C20H23FN2O3S/c1-13-7-8-16(11-14(13)2)22-20(24)18-12-17(9-10-19(18)21)27(25,26)23-15-5-3-4-6-15/h7-12,15,23H,3-6H2,1-2H3,(H,22,24)
InChIKeyLFQVCVXEZBSFTH-UHFFFAOYSA-N
MW390.48 g/mol
LogP3.92
Rot. Bonds5

About 5-(cyclopentylsulfamoyl)-N-(3,4-dimethylphenyl)-2-fluorobenzamide

5-(cyclopentylsulfamoyl)-N-(3,4-dimethylphenyl)-2-fluorobenzamide (PubChem CID 4643786) has the molecular formula C20H23FN2O3S and a molecular weight of 390.48 g/mol. Its IUPAC name is 5-(cyclopentylsulfamoyl)-N-(3,4-dimethylphenyl)-2-fluorobenzamide.

Molecular Properties

Compound Name5-(cyclopentylsulfamoyl)-N-(3,4-dimethylphenyl)-2-fluorobenzamide
PubChem CID4643786
Molecular FormulaC20H23FN2O3S
Molecular Weight390.48 g/mol
Exact Mass390.14
IUPAC Name5-(cyclopentylsulfamoyl)-N-(3,4-dimethylphenyl)-2-fluorobenzamide
SMILESCc1ccc(NC(=O)c2cc(S(=O)(=O)NC3CCCC3)ccc2F)cc1C
InChIInChI=1S/C20H23FN2O3S/c1-13-7-8-16(11-14(13)2)22-20(24)18-12-17(9-10-19(18)21)27(25,26)23-15-5-3-4-6-15/h7-12,15,23H,3-6H2,1-2H3,(H,22,24)
InChIKeyLFQVCVXEZBSFTH-UHFFFAOYSA-N
XLogP3.92
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 ≤ 53.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(cyclopentylsulfamoyl)-2-fluoro-N-(3-methylphenyl)benzamide
CID 5157745
5-(cyclohexylsulfamoyl)-2-fluoro-N-(4-fluorophenyl)benzamide
CID 118285426
5-(cyclopentylsulfamoyl)-N-(3,5-dichlorophenyl)-2-fluorobenzamide
CID 4190475
5-(cyclohexylsulfamoyl)-N-(3,5-dichlorophenyl)-2-fluorobenzamide
CID 4190474
5-chloro-N-[4-(cyclopentylsulfamoyl)phenyl]-2-fluorobenzamide
CID 119045142
N-(3-chlorophenyl)-5-(cyclohexylsulfamoyl)-2-fluorobenzamide
CID 90075218
N-[4-(cyclopentylsulfamoyl)phenyl]-5-fluoro-2-methylbenzamide
CID 119045157
5-(cyclohexylsulfamoyl)-N-(2,3-dimethylphenyl)-2-fluorobenzamide
CID 4102001
N-(3-chloro-2-methylphenyl)-5-(cyclohexylsulfamoyl)-2-fluorobenzamide
CID 3452162
5-[[(1R)-1-cyclopentylethyl]sulfamoyl]-N-(3,4-difluorophenyl)-2-fluorobenzamide
CID 90269965
5-(cyclohexylsulfamoyl)-N-(2-ethylphenyl)-2-fluorobenzamide
CID 4685317
N-(3-chlorophenyl)-5-(cyclopropylsulfamoyl)-2-methylbenzamide
CID 34744641

Frequently Asked Questions

What is the IUPAC name of 5-(cyclopentylsulfamoyl)-N-(3,4-dimethylphenyl)-2-fluorobenzamide?
The IUPAC name of 5-(cyclopentylsulfamoyl)-N-(3,4-dimethylphenyl)-2-fluorobenzamide (CID 4643786) is 5-(cyclopentylsulfamoyl)-N-(3,4-dimethylphenyl)-2-fluorobenzamide.
What is the SMILES notation for 5-(cyclopentylsulfamoyl)-N-(3,4-dimethylphenyl)-2-fluorobenzamide?
The canonical SMILES for 5-(cyclopentylsulfamoyl)-N-(3,4-dimethylphenyl)-2-fluorobenzamide is Cc1ccc(NC(=O)c2cc(S(=O)(=O)NC3CCCC3)ccc2F)cc1C.
What is the InChIKey of 5-(cyclopentylsulfamoyl)-N-(3,4-dimethylphenyl)-2-fluorobenzamide?
The InChIKey is LFQVCVXEZBSFTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23FN2O3S/c1-13-7-8-16(11-14(13)2)22-20(24)18-12-17(9-10-19(18)21)27(25,26)23-15-5-3-4-6-15/h7-12,15,23H,3-6H2,1-2H3,(H,22,24).
What are the key properties of 5-(cyclopentylsulfamoyl)-N-(3,4-dimethylphenyl)-2-fluorobenzamide?
5-(cyclopentylsulfamoyl)-N-(3,4-dimethylphenyl)-2-fluorobenzamide has a molecular weight of 390.48 g/mol, XLogP of 3.92, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopentylsulfamoyl)-N-(3,4-dimethylphenyl)-2-fluorobenzamide is sourced from PubChem (CID 4643786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).