N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-4-pyrrol-1-ylbenzamide

C24H27N3O3S — CID 108736292

IUPACN-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-4-pyrrol-1-ylbenzamide
SMILESO=C(NCCc1ccc(S(=O)(=O)NC2CCCC2)cc1)c1ccc(-n2cccc2)cc1
InChIInChI=1S/C24H27N3O3S/c28-24(20-9-11-22(12-10-20)27-17-3-4-18-27)25-16-15-19-7-13-23(14-8-19)31(29,30)26-21-5-1-2-6-21/h3-4,7-14,17-18,21,26H,1-2,5-6,15-16H2,(H,25,28)
InChIKeyHYIDGWSTBPQUBX-UHFFFAOYSA-N
MW437.57 g/mol
LogP3.67
Rot. Bonds8

About N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-4-pyrrol-1-ylbenzamide

N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-4-pyrrol-1-ylbenzamide (PubChem CID 108736292) has the molecular formula C24H27N3O3S and a molecular weight of 437.57 g/mol. Its IUPAC name is N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-4-pyrrol-1-ylbenzamide.

Molecular Properties

Compound NameN-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-4-pyrrol-1-ylbenzamide
PubChem CID108736292
Molecular FormulaC24H27N3O3S
Molecular Weight437.57 g/mol
Exact Mass437.18
IUPAC NameN-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-4-pyrrol-1-ylbenzamide
SMILESO=C(NCCc1ccc(S(=O)(=O)NC2CCCC2)cc1)c1ccc(-n2cccc2)cc1
InChIInChI=1S/C24H27N3O3S/c28-24(20-9-11-22(12-10-20)27-17-3-4-18-27)25-16-15-19-7-13-23(14-8-19)31(29,30)26-21-5-1-2-6-21/h3-4,7-14,17-18,21,26H,1-2,5-6,15-16H2,(H,25,28)
InChIKeyHYIDGWSTBPQUBX-UHFFFAOYSA-N
XLogP3.67
TPSA80.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.57
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-4-pyrrol-1-ylbenzamide 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-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-3-methylbenzamide
CID 108736298
4-(cyclobutylsulfamoyl)-N-(2-pyridin-3-ylethyl)benzamide
CID 70717840
N-[2-(4-chlorophenyl)ethyl]-4-pyrrol-1-ylbenzamide
CID 9403209
N-[2-(4-fluorophenyl)ethyl]-4-pyrrol-1-ylbenzamide
CID 9402673
4-(cyclopentylsulfamoyl)-N-(furan-3-ylmethyl)benzamide
CID 70751779
4-(cycloheptylsulfamoyl)-N-(3-methylbutyl)benzamide
CID 109061209
4-(cyclohexylsulfamoyl)-N-pentylbenzamide
CID 109059553
4-(cyclopentylsulfamoyl)-N-(3-methoxypropyl)benzamide
CID 109059323
N-[2-[4-(cyclohexylsulfamoyl)phenyl]ethyl]-2-oxo-2-piperidin-1-ylacetamide
CID 30126755
4-(cyclobutylsulfamoyl)-N-(2-pyrazin-2-ylethyl)benzamide
CID 70785168
N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-2-methyl-3-nitrobenzamide
CID 108736405
3-chloro-N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-2,2-dimethylpropanamide
CID 108759314

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-4-pyrrol-1-ylbenzamide?
The IUPAC name of N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-4-pyrrol-1-ylbenzamide (CID 108736292) is N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-4-pyrrol-1-ylbenzamide.
What is the SMILES notation for N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-4-pyrrol-1-ylbenzamide?
The canonical SMILES for N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-4-pyrrol-1-ylbenzamide is O=C(NCCc1ccc(S(=O)(=O)NC2CCCC2)cc1)c1ccc(-n2cccc2)cc1.
What is the InChIKey of N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-4-pyrrol-1-ylbenzamide?
The InChIKey is HYIDGWSTBPQUBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O3S/c28-24(20-9-11-22(12-10-20)27-17-3-4-18-27)25-16-15-19-7-13-23(14-8-19)31(29,30)26-21-5-1-2-6-21/h3-4,7-14,17-18,21,26H,1-2,5-6,15-16H2,(H,25,28).
What are the key properties of N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-4-pyrrol-1-ylbenzamide?
N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-4-pyrrol-1-ylbenzamide has a molecular weight of 437.57 g/mol, XLogP of 3.67, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-4-pyrrol-1-ylbenzamide is sourced from PubChem (CID 108736292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).