N-cyclopentyl-5-[2-(methanesulfonamido)phenyl]-2-methoxybenzenesulfonamide

C19H24N2O5S2 — CID 122191039

IUPACN-cyclopentyl-5-[2-(methanesulfonamido)phenyl]-2-methoxybenzenesulfonamide
SMILESCOc1ccc(-c2ccccc2NS(C)(=O)=O)cc1S(=O)(=O)NC1CCCC1
InChIInChI=1S/C19H24N2O5S2/c1-26-18-12-11-14(16-9-5-6-10-17(16)21-27(2,22)23)13-19(18)28(24,25)20-15-7-3-4-8-15/h5-6,9-13,15,20-21H,3-4,7-8H2,1-2H3
InChIKeyFUTSSXNASMGADG-UHFFFAOYSA-N
MW424.54 g/mol
LogP2.95
Rot. Bonds7

About N-cyclopentyl-5-[2-(methanesulfonamido)phenyl]-2-methoxybenzenesulfonamide

N-cyclopentyl-5-[2-(methanesulfonamido)phenyl]-2-methoxybenzenesulfonamide (PubChem CID 122191039) has the molecular formula C19H24N2O5S2 and a molecular weight of 424.54 g/mol. Its IUPAC name is N-cyclopentyl-5-[2-(methanesulfonamido)phenyl]-2-methoxybenzenesulfonamide.

Molecular Properties

Compound NameN-cyclopentyl-5-[2-(methanesulfonamido)phenyl]-2-methoxybenzenesulfonamide
PubChem CID122191039
Molecular FormulaC19H24N2O5S2
Molecular Weight424.54 g/mol
Exact Mass424.11
IUPAC NameN-cyclopentyl-5-[2-(methanesulfonamido)phenyl]-2-methoxybenzenesulfonamide
SMILESCOc1ccc(-c2ccccc2NS(C)(=O)=O)cc1S(=O)(=O)NC1CCCC1
InChIInChI=1S/C19H24N2O5S2/c1-26-18-12-11-14(16-9-5-6-10-17(16)21-27(2,22)23)13-19(18)28(24,25)20-15-7-3-4-8-15/h5-6,9-13,15,20-21H,3-4,7-8H2,1-2H3
InChIKeyFUTSSXNASMGADG-UHFFFAOYSA-N
XLogP2.95
TPSA101.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.54
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopentyl-2-methoxy-5-(2-methylthiophen-3-yl)benzenesulfonamide
CID 122191055
N-cyclopentyl-2-methoxy-5-(5-phenyl-1,3,4-oxadiazol-2-yl)benzenesulfonamide
CID 53098172
N-cyclopentyl-5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methoxybenzenesulfonamide
CID 53054200
N-cyclopentyl-4-methoxynaphthalene-1-sulfonamide
CID 7314514
N-(2-bromophenyl)-3-(cyclopentylsulfamoyl)-4-methoxybenzamide
CID 26536733
3-(cyclopentylsulfamoyl)-4-methoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide
CID 55700493
5-(aminomethyl)-N-cyclohexyl-2-methoxybenzenesulfonamide
CID 28717716
N-cyclopentyl-2-methoxy-4-methylbenzenesulfonamide
CID 172906018
N-cyclopentyl-2-methoxy-5-[3-[2-(methylamino)propyl]-1,2,4-oxadiazol-5-yl]benzenesulfonamide
CID 120869072
N-[2-(4-methoxyphenyl)phenyl]methanesulfonamide
CID 23508536
N-cyclohexyl-5-(4-methoxyphthalazin-1-yl)-2-methylbenzenesulfonamide
CID 2928176
3-(cyclobutylsulfamoyl)-4-methoxybenzoic acid
CID 55067218

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-5-[2-(methanesulfonamido)phenyl]-2-methoxybenzenesulfonamide?
The IUPAC name of N-cyclopentyl-5-[2-(methanesulfonamido)phenyl]-2-methoxybenzenesulfonamide (CID 122191039) is N-cyclopentyl-5-[2-(methanesulfonamido)phenyl]-2-methoxybenzenesulfonamide.
What is the SMILES notation for N-cyclopentyl-5-[2-(methanesulfonamido)phenyl]-2-methoxybenzenesulfonamide?
The canonical SMILES for N-cyclopentyl-5-[2-(methanesulfonamido)phenyl]-2-methoxybenzenesulfonamide is COc1ccc(-c2ccccc2NS(C)(=O)=O)cc1S(=O)(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-5-[2-(methanesulfonamido)phenyl]-2-methoxybenzenesulfonamide?
The InChIKey is FUTSSXNASMGADG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O5S2/c1-26-18-12-11-14(16-9-5-6-10-17(16)21-27(2,22)23)13-19(18)28(24,25)20-15-7-3-4-8-15/h5-6,9-13,15,20-21H,3-4,7-8H2,1-2H3.
What are the key properties of N-cyclopentyl-5-[2-(methanesulfonamido)phenyl]-2-methoxybenzenesulfonamide?
N-cyclopentyl-5-[2-(methanesulfonamido)phenyl]-2-methoxybenzenesulfonamide has a molecular weight of 424.54 g/mol, XLogP of 2.95, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-5-[2-(methanesulfonamido)phenyl]-2-methoxybenzenesulfonamide is sourced from PubChem (CID 122191039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).