4-cyclopentyloxy-N-(1-phenylcyclobutyl)benzenesulfonamide

C21H25NO3S — CID 113091508

IUPAC4-cyclopentyloxy-N-(1-phenylcyclobutyl)benzenesulfonamide
SMILESO=S(=O)(NC1(c2ccccc2)CCC1)c1ccc(OC2CCCC2)cc1
InChIInChI=1S/C21H25NO3S/c23-26(24,22-21(15-6-16-21)17-7-2-1-3-8-17)20-13-11-19(12-14-20)25-18-9-4-5-10-18/h1-3,7-8,11-14,18,22H,4-6,9-10,15-16H2
InChIKeyURSISJOFJLLONH-UHFFFAOYSA-N
MW371.50 g/mol
LogP4.37
Rot. Bonds6

About 4-cyclopentyloxy-N-(1-phenylcyclobutyl)benzenesulfonamide

4-cyclopentyloxy-N-(1-phenylcyclobutyl)benzenesulfonamide (PubChem CID 113091508) has the molecular formula C21H25NO3S and a molecular weight of 371.50 g/mol. Its IUPAC name is 4-cyclopentyloxy-N-(1-phenylcyclobutyl)benzenesulfonamide.

Molecular Properties

Compound Name4-cyclopentyloxy-N-(1-phenylcyclobutyl)benzenesulfonamide
PubChem CID113091508
Molecular FormulaC21H25NO3S
Molecular Weight371.50 g/mol
Exact Mass371.16
IUPAC Name4-cyclopentyloxy-N-(1-phenylcyclobutyl)benzenesulfonamide
SMILESO=S(=O)(NC1(c2ccccc2)CCC1)c1ccc(OC2CCCC2)cc1
InChIInChI=1S/C21H25NO3S/c23-26(24,22-21(15-6-16-21)17-7-2-1-3-8-17)20-13-11-19(12-14-20)25-18-9-4-5-10-18/h1-3,7-8,11-14,18,22H,4-6,9-10,15-16H2
InChIKeyURSISJOFJLLONH-UHFFFAOYSA-N
XLogP4.37
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.50
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-fluoro-N-(1-phenylcyclopropyl)benzenesulfonamide
CID 110446070
4-cyclopentyloxy-N-[[1-(hydroxymethyl)cyclopentyl]methyl]benzenesulfonamide
CID 110642380
4-cyclopentyloxy-N-(2-pyridin-2-ylpropan-2-yl)benzenesulfonamide
CID 113091949
4-cyclopentyloxybenzenesulfonamide
CID 43164525
4-cyclopentyloxy-N-[2-(2-hydroxyphenyl)ethyl]benzenesulfonamide
CID 110605334
N-(5-benzyl-2-hydroxyphenyl)-4-cyclopentyloxybenzenesulfonamide
CID 146146612
4-cyclopentyloxy-N-[2-(1H-pyrazol-5-yl)ethyl]benzenesulfonamide
CID 110731903
2,4-dioxo-N-(1-phenylcyclopentyl)-1H-quinazoline-6-sulfonamide
CID 46966742
4-cyclopentyloxy-N-(1-pyridin-2-ylethyl)benzenesulfonamide
CID 110724466
4-cyclopentyloxy-N-[4-(trifluoromethyl)phenyl]benzenesulfonamide
CID 113098678
N-[1-(3-chlorophenyl)cyclopentyl]-4-(trifluoromethoxy)benzenesulfonamide
CID 164862821
N-[(4-chlorophenyl)methyl]-4-cyclopentyloxybenzenesulfonamide
CID 113098120

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyloxy-N-(1-phenylcyclobutyl)benzenesulfonamide?
The IUPAC name of 4-cyclopentyloxy-N-(1-phenylcyclobutyl)benzenesulfonamide (CID 113091508) is 4-cyclopentyloxy-N-(1-phenylcyclobutyl)benzenesulfonamide.
What is the SMILES notation for 4-cyclopentyloxy-N-(1-phenylcyclobutyl)benzenesulfonamide?
The canonical SMILES for 4-cyclopentyloxy-N-(1-phenylcyclobutyl)benzenesulfonamide is O=S(=O)(NC1(c2ccccc2)CCC1)c1ccc(OC2CCCC2)cc1.
What is the InChIKey of 4-cyclopentyloxy-N-(1-phenylcyclobutyl)benzenesulfonamide?
The InChIKey is URSISJOFJLLONH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25NO3S/c23-26(24,22-21(15-6-16-21)17-7-2-1-3-8-17)20-13-11-19(12-14-20)25-18-9-4-5-10-18/h1-3,7-8,11-14,18,22H,4-6,9-10,15-16H2.
What are the key properties of 4-cyclopentyloxy-N-(1-phenylcyclobutyl)benzenesulfonamide?
4-cyclopentyloxy-N-(1-phenylcyclobutyl)benzenesulfonamide has a molecular weight of 371.50 g/mol, XLogP of 4.37, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyloxy-N-(1-phenylcyclobutyl)benzenesulfonamide is sourced from PubChem (CID 113091508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).