N-(4-cyclopentyloxyphenyl)-2,6-difluorobenzenesulfonamide

C17H17F2NO3S — CID 35548239

IUPACN-(4-cyclopentyloxyphenyl)-2,6-difluorobenzenesulfonamide
SMILESO=S(=O)(Nc1ccc(OC2CCCC2)cc1)c1c(F)cccc1F
InChIInChI=1S/C17H17F2NO3S/c18-15-6-3-7-16(19)17(15)24(21,22)20-12-8-10-14(11-9-12)23-13-4-1-2-5-13/h3,6-11,13,20H,1-2,4-5H2
InChIKeyYADPMOFFVBXOAL-UHFFFAOYSA-N
MW353.39 g/mol
LogP4.09
Rot. Bonds5

About N-(4-cyclopentyloxyphenyl)-2,6-difluorobenzenesulfonamide

N-(4-cyclopentyloxyphenyl)-2,6-difluorobenzenesulfonamide (PubChem CID 35548239) has the molecular formula C17H17F2NO3S and a molecular weight of 353.39 g/mol. Its IUPAC name is N-(4-cyclopentyloxyphenyl)-2,6-difluorobenzenesulfonamide.

Molecular Properties

Compound NameN-(4-cyclopentyloxyphenyl)-2,6-difluorobenzenesulfonamide
PubChem CID35548239
Molecular FormulaC17H17F2NO3S
Molecular Weight353.39 g/mol
Exact Mass353.09
IUPAC NameN-(4-cyclopentyloxyphenyl)-2,6-difluorobenzenesulfonamide
SMILESO=S(=O)(Nc1ccc(OC2CCCC2)cc1)c1c(F)cccc1F
InChIInChI=1S/C17H17F2NO3S/c18-15-6-3-7-16(19)17(15)24(21,22)20-12-8-10-14(11-9-12)23-13-4-1-2-5-13/h3,6-11,13,20H,1-2,4-5H2
InChIKeyYADPMOFFVBXOAL-UHFFFAOYSA-N
XLogP4.09
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.39
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-cyclopentyloxyphenyl)-2,5-difluorobenzenesulfonamide
CID 35548330
4-cyclopentyloxy-N-[4-(trifluoromethyl)phenyl]benzenesulfonamide
CID 113098678
methyl 2-[(4-cyclopentyloxyphenyl)sulfamoyl]benzoate
CID 55572892
N-(3-cyclopentyloxyphenyl)-3,4-difluorobenzenesulfonamide
CID 35547755
5-chloro-N-(4-cyclopentyloxyphenyl)thiophene-2-sulfonamide
CID 35548201
N-(4-cyclopentyloxyphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide
CID 35548290
methyl 3-[(4-cyclopentyloxyphenyl)sulfonylamino]benzoate
CID 110424099
4-[(2,6-difluorophenyl)sulfonylamino]benzamide
CID 4880807
N-(1,3-benzodioxol-5-yl)-4-cyclopentyloxybenzenesulfonamide
CID 110426256
N-(3,4-dimethylphenyl)-2,6-difluorobenzenesulfonamide
CID 4793269
N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2,6-difluorobenzenesulfonamide
CID 3714475
4-cycloheptyloxy-N-methylaniline
CID 82930112

Frequently Asked Questions

What is the IUPAC name of N-(4-cyclopentyloxyphenyl)-2,6-difluorobenzenesulfonamide?
The IUPAC name of N-(4-cyclopentyloxyphenyl)-2,6-difluorobenzenesulfonamide (CID 35548239) is N-(4-cyclopentyloxyphenyl)-2,6-difluorobenzenesulfonamide.
What is the SMILES notation for N-(4-cyclopentyloxyphenyl)-2,6-difluorobenzenesulfonamide?
The canonical SMILES for N-(4-cyclopentyloxyphenyl)-2,6-difluorobenzenesulfonamide is O=S(=O)(Nc1ccc(OC2CCCC2)cc1)c1c(F)cccc1F.
What is the InChIKey of N-(4-cyclopentyloxyphenyl)-2,6-difluorobenzenesulfonamide?
The InChIKey is YADPMOFFVBXOAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17F2NO3S/c18-15-6-3-7-16(19)17(15)24(21,22)20-12-8-10-14(11-9-12)23-13-4-1-2-5-13/h3,6-11,13,20H,1-2,4-5H2.
What are the key properties of N-(4-cyclopentyloxyphenyl)-2,6-difluorobenzenesulfonamide?
N-(4-cyclopentyloxyphenyl)-2,6-difluorobenzenesulfonamide has a molecular weight of 353.39 g/mol, XLogP of 4.09, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyclopentyloxyphenyl)-2,6-difluorobenzenesulfonamide is sourced from PubChem (CID 35548239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).