1-(benzenesulfonyl)-N-(4-ethoxyphenyl)cyclopentane-1-carboxamide

C20H23NO4S — CID 17390768

IUPAC1-(benzenesulfonyl)-N-(4-ethoxyphenyl)cyclopentane-1-carboxamide
SMILESCCOc1ccc(NC(=O)C2(S(=O)(=O)c3ccccc3)CCCC2)cc1
InChIInChI=1S/C20H23NO4S/c1-2-25-17-12-10-16(11-13-17)21-19(22)20(14-6-7-15-20)26(23,24)18-8-4-3-5-9-18/h3-5,8-13H,2,6-7,14-15H2,1H3,(H,21,22)
InChIKeyZEBAMCCVKUWYQG-UHFFFAOYSA-N
MW373.47 g/mol
LogP3.81
Rot. Bonds6

About 1-(benzenesulfonyl)-N-(4-ethoxyphenyl)cyclopentane-1-carboxamide

1-(benzenesulfonyl)-N-(4-ethoxyphenyl)cyclopentane-1-carboxamide (PubChem CID 17390768) has the molecular formula C20H23NO4S and a molecular weight of 373.47 g/mol. Its IUPAC name is 1-(benzenesulfonyl)-N-(4-ethoxyphenyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(benzenesulfonyl)-N-(4-ethoxyphenyl)cyclopentane-1-carboxamide
PubChem CID17390768
Molecular FormulaC20H23NO4S
Molecular Weight373.47 g/mol
Exact Mass373.13
IUPAC Name1-(benzenesulfonyl)-N-(4-ethoxyphenyl)cyclopentane-1-carboxamide
SMILESCCOc1ccc(NC(=O)C2(S(=O)(=O)c3ccccc3)CCCC2)cc1
InChIInChI=1S/C20H23NO4S/c1-2-25-17-12-10-16(11-13-17)21-19(22)20(14-6-7-15-20)26(23,24)18-8-4-3-5-9-18/h3-5,8-13H,2,6-7,14-15H2,1H3,(H,21,22)
InChIKeyZEBAMCCVKUWYQG-UHFFFAOYSA-N
XLogP3.81
TPSA72.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.47
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(benzenesulfonyl)-N-(4-ethoxyphenyl)cyclopentane-1-carboxamide 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

1-(4-chlorophenyl)sulfonyl-N-(4-ethoxyphenyl)cyclopropane-1-carboxamide
CID 2318019
1-(benzenesulfonyl)-N-phenylcyclopentane-1-carboxamide
CID 17438426
1-(benzenesulfonyl)-N-[3-(diethylsulfamoyl)phenyl]cyclopentane-1-carboxamide
CID 16590699
1-(4-chlorophenyl)sulfonyl-N-(4-ethylsulfonylphenyl)cyclopentane-1-carboxamide
CID 55496237
1-(4-chlorophenyl)sulfonyl-N-(2-ethoxyphenyl)cyclopentane-1-carboxamide
CID 41486617
1-(benzenesulfonyl)-N-(3-methyl-2-pyridinyl)cyclopentane-1-carboxamide
CID 23732618
1-(benzenesulfonyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)cyclopentane-1-carboxamide
CID 16592029
N-(4-ethoxyphenyl)-1-propoxycyclopentane-1-carboxamide
CID 100712217
(4S)-N-(4-ethoxyphenyl)-1-ethyl-4-phenylazepane-4-carboxamide
CID 95100675
N-(4-ethoxyphenyl)-1-(4-methoxyphenyl)cyclopentane-1-carboxamide
CID 94829289
1-(benzenesulfonyl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]cyclopentane-1-carboxamide
CID 30765886
1-ethoxy-N-(4-phenylmethoxyphenyl)cycloheptane-1-carboxamide
CID 100731226

Frequently Asked Questions

What is the IUPAC name of 1-(benzenesulfonyl)-N-(4-ethoxyphenyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-(benzenesulfonyl)-N-(4-ethoxyphenyl)cyclopentane-1-carboxamide (CID 17390768) is 1-(benzenesulfonyl)-N-(4-ethoxyphenyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(benzenesulfonyl)-N-(4-ethoxyphenyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-(benzenesulfonyl)-N-(4-ethoxyphenyl)cyclopentane-1-carboxamide is CCOc1ccc(NC(=O)C2(S(=O)(=O)c3ccccc3)CCCC2)cc1.
What is the InChIKey of 1-(benzenesulfonyl)-N-(4-ethoxyphenyl)cyclopentane-1-carboxamide?
The InChIKey is ZEBAMCCVKUWYQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO4S/c1-2-25-17-12-10-16(11-13-17)21-19(22)20(14-6-7-15-20)26(23,24)18-8-4-3-5-9-18/h3-5,8-13H,2,6-7,14-15H2,1H3,(H,21,22).
What are the key properties of 1-(benzenesulfonyl)-N-(4-ethoxyphenyl)cyclopentane-1-carboxamide?
1-(benzenesulfonyl)-N-(4-ethoxyphenyl)cyclopentane-1-carboxamide has a molecular weight of 373.47 g/mol, XLogP of 3.81, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(benzenesulfonyl)-N-(4-ethoxyphenyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 17390768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).