4-(tert-butylsulfamoyl)-N-[1-(4-methoxyphenyl)cyclopentyl]benzamide

C23H30N2O4S — CID 60618187

IUPAC4-(tert-butylsulfamoyl)-N-[1-(4-methoxyphenyl)cyclopentyl]benzamide
SMILESCOc1ccc(C2(NC(=O)c3ccc(S(=O)(=O)NC(C)(C)C)cc3)CCCC2)cc1
InChIInChI=1S/C23H30N2O4S/c1-22(2,3)25-30(27,28)20-13-7-17(8-14-20)21(26)24-23(15-5-6-16-23)18-9-11-19(29-4)12-10-18/h7-14,25H,5-6,15-16H2,1-4H3,(H,24,26)
InChIKeyHHOIQJXNZXHMGH-UHFFFAOYSA-N
MW430.57 g/mol
LogP3.97
Rot. Bonds6

About 4-(tert-butylsulfamoyl)-N-[1-(4-methoxyphenyl)cyclopentyl]benzamide

4-(tert-butylsulfamoyl)-N-[1-(4-methoxyphenyl)cyclopentyl]benzamide (PubChem CID 60618187) has the molecular formula C23H30N2O4S and a molecular weight of 430.57 g/mol. Its IUPAC name is 4-(tert-butylsulfamoyl)-N-[1-(4-methoxyphenyl)cyclopentyl]benzamide.

Molecular Properties

Compound Name4-(tert-butylsulfamoyl)-N-[1-(4-methoxyphenyl)cyclopentyl]benzamide
PubChem CID60618187
Molecular FormulaC23H30N2O4S
Molecular Weight430.57 g/mol
Exact Mass430.19
IUPAC Name4-(tert-butylsulfamoyl)-N-[1-(4-methoxyphenyl)cyclopentyl]benzamide
SMILESCOc1ccc(C2(NC(=O)c3ccc(S(=O)(=O)NC(C)(C)C)cc3)CCCC2)cc1
InChIInChI=1S/C23H30N2O4S/c1-22(2,3)25-30(27,28)20-13-7-17(8-14-20)21(26)24-23(15-5-6-16-23)18-9-11-19(29-4)12-10-18/h7-14,25H,5-6,15-16H2,1-4H3,(H,24,26)
InChIKeyHHOIQJXNZXHMGH-UHFFFAOYSA-N
XLogP3.97
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.57
LogP ≤ 53.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(4-fluorophenyl)cyclopropyl]-4-methoxybenzamide
CID 110440290
3-[(4-methoxyphenyl)-methylsulfamoyl]-N-(1-phenylcyclobutyl)benzamide
CID 55461953
N-[1-(4-methoxyphenyl)cyclohexyl]-2-methylpropanamide
CID 110478522
5-[[1-(4-methoxyphenyl)cyclopentyl]carbamoyl]pyrazine-2-carboxylic acid
CID 120685365
methyl 1-[(4-methoxyphenyl)sulfonylamino]cyclohexane-1-carboxylate
CID 22907072
4-(tert-butylsulfamoyl)-N-cyclopentylbenzamide
CID 18106170
1-[(4-methoxyphenyl)sulfonylamino]cyclohexane-1-carboxylic acid
CID 974157
[4-[[4-(tert-butylsulfamoyl)phenyl]carbamoyl]phenyl] acetate
CID 1311332
N-[1-(4-methoxyphenyl)cyclopentyl]-2-[4-(trifluoromethyl)phenyl]acetamide
CID 52845959
N-tert-butyl-4-(2-methoxyethoxy)benzenesulfonamide
CID 35291114
N-[1-(4-methoxyphenyl)cyclobutyl]cyclopropanecarboxamide
CID 110478167
N-[1-(aminomethyl)cyclopentyl]-4-methoxybenzamide;hydrochloride
CID 119566284

Frequently Asked Questions

What is the IUPAC name of 4-(tert-butylsulfamoyl)-N-[1-(4-methoxyphenyl)cyclopentyl]benzamide?
The IUPAC name of 4-(tert-butylsulfamoyl)-N-[1-(4-methoxyphenyl)cyclopentyl]benzamide (CID 60618187) is 4-(tert-butylsulfamoyl)-N-[1-(4-methoxyphenyl)cyclopentyl]benzamide.
What is the SMILES notation for 4-(tert-butylsulfamoyl)-N-[1-(4-methoxyphenyl)cyclopentyl]benzamide?
The canonical SMILES for 4-(tert-butylsulfamoyl)-N-[1-(4-methoxyphenyl)cyclopentyl]benzamide is COc1ccc(C2(NC(=O)c3ccc(S(=O)(=O)NC(C)(C)C)cc3)CCCC2)cc1.
What is the InChIKey of 4-(tert-butylsulfamoyl)-N-[1-(4-methoxyphenyl)cyclopentyl]benzamide?
The InChIKey is HHOIQJXNZXHMGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O4S/c1-22(2,3)25-30(27,28)20-13-7-17(8-14-20)21(26)24-23(15-5-6-16-23)18-9-11-19(29-4)12-10-18/h7-14,25H,5-6,15-16H2,1-4H3,(H,24,26).
What are the key properties of 4-(tert-butylsulfamoyl)-N-[1-(4-methoxyphenyl)cyclopentyl]benzamide?
4-(tert-butylsulfamoyl)-N-[1-(4-methoxyphenyl)cyclopentyl]benzamide has a molecular weight of 430.57 g/mol, XLogP of 3.97, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(tert-butylsulfamoyl)-N-[1-(4-methoxyphenyl)cyclopentyl]benzamide is sourced from PubChem (CID 60618187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).