2-(3-aminocyclopentyl)oxy-N-ethylbenzenesulfonamide

C13H20N2O3S — CID 79465618

IUPAC2-(3-aminocyclopentyl)oxy-N-ethylbenzenesulfonamide
SMILESCCNS(=O)(=O)c1ccccc1OC1CCC(N)C1
InChIInChI=1S/C13H20N2O3S/c1-2-15-19(16,17)13-6-4-3-5-12(13)18-11-8-7-10(14)9-11/h3-6,10-11,15H,2,7-9,14H2,1H3
InChIKeyXGSYCIFNNWUTQU-UHFFFAOYSA-N
MW284.38 g/mol
LogP1.24
Rot. Bonds5

About 2-(3-aminocyclopentyl)oxy-N-ethylbenzenesulfonamide

2-(3-aminocyclopentyl)oxy-N-ethylbenzenesulfonamide (PubChem CID 79465618) has the molecular formula C13H20N2O3S and a molecular weight of 284.38 g/mol. Its IUPAC name is 2-(3-aminocyclopentyl)oxy-N-ethylbenzenesulfonamide.

Molecular Properties

Compound Name2-(3-aminocyclopentyl)oxy-N-ethylbenzenesulfonamide
PubChem CID79465618
Molecular FormulaC13H20N2O3S
Molecular Weight284.38 g/mol
Exact Mass284.12
IUPAC Name2-(3-aminocyclopentyl)oxy-N-ethylbenzenesulfonamide
SMILESCCNS(=O)(=O)c1ccccc1OC1CCC(N)C1
InChIInChI=1S/C13H20N2O3S/c1-2-15-19(16,17)13-6-4-3-5-12(13)18-11-8-7-10(14)9-11/h3-6,10-11,15H,2,7-9,14H2,1H3
InChIKeyXGSYCIFNNWUTQU-UHFFFAOYSA-N
XLogP1.24
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-aminocyclopentyl)oxy-N-cyclopropylbenzenesulfonamide
CID 79465932
3-(2-propylsulfonylphenoxy)cyclopentan-1-amine
CID 79465726
N-ethyl-2-piperidin-4-yloxybenzenesulfonamide
CID 62344419
2-[(4-aminocyclohexyl)amino]-N-ethylbenzenesulfonamide
CID 62313487
3-(2-butan-2-ylphenoxy)cyclopentan-1-amine
CID 79643132
2-(3-aminoazetidin-1-yl)-N-ethylbenzenesulfonamide
CID 63760577
3-(4-ethylsulfonylphenoxy)cyclopentan-1-amine
CID 79466034
N-ethyl-2-[(4-hydroxycyclohexyl)amino]benzenesulfonamide
CID 43454387
2-(3-aminocyclopentyl)oxybenzonitrile
CID 79465196
ethyl 2-(ethylsulfamoyl)benzoate
CID 18338374
2-[(3R)-3-aminopiperidin-1-yl]-N-ethylbenzenesulfonamide
CID 102986774
2-[(1,1-dioxothian-4-yl)amino]-N-ethylbenzenesulfonamide
CID 43615439

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminocyclopentyl)oxy-N-ethylbenzenesulfonamide?
The IUPAC name of 2-(3-aminocyclopentyl)oxy-N-ethylbenzenesulfonamide (CID 79465618) is 2-(3-aminocyclopentyl)oxy-N-ethylbenzenesulfonamide.
What is the SMILES notation for 2-(3-aminocyclopentyl)oxy-N-ethylbenzenesulfonamide?
The canonical SMILES for 2-(3-aminocyclopentyl)oxy-N-ethylbenzenesulfonamide is CCNS(=O)(=O)c1ccccc1OC1CCC(N)C1.
What is the InChIKey of 2-(3-aminocyclopentyl)oxy-N-ethylbenzenesulfonamide?
The InChIKey is XGSYCIFNNWUTQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3S/c1-2-15-19(16,17)13-6-4-3-5-12(13)18-11-8-7-10(14)9-11/h3-6,10-11,15H,2,7-9,14H2,1H3.
What are the key properties of 2-(3-aminocyclopentyl)oxy-N-ethylbenzenesulfonamide?
2-(3-aminocyclopentyl)oxy-N-ethylbenzenesulfonamide has a molecular weight of 284.38 g/mol, XLogP of 1.24, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminocyclopentyl)oxy-N-ethylbenzenesulfonamide is sourced from PubChem (CID 79465618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).