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

C14H20N2O3S — CID 79465932

IUPAC2-(3-aminocyclopentyl)oxy-N-cyclopropylbenzenesulfonamide
SMILESNC1CCC(Oc2ccccc2S(=O)(=O)NC2CC2)C1
InChIInChI=1S/C14H20N2O3S/c15-10-5-8-12(9-10)19-13-3-1-2-4-14(13)20(17,18)16-11-6-7-11/h1-4,10-12,16H,5-9,15H2
InChIKeyVUIAAMAVKKWBCP-UHFFFAOYSA-N
MW296.39 g/mol
LogP1.39
Rot. Bonds5

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

2-(3-aminocyclopentyl)oxy-N-cyclopropylbenzenesulfonamide (PubChem CID 79465932) has the molecular formula C14H20N2O3S and a molecular weight of 296.39 g/mol. Its IUPAC name is 2-(3-aminocyclopentyl)oxy-N-cyclopropylbenzenesulfonamide.

Molecular Properties

Compound Name2-(3-aminocyclopentyl)oxy-N-cyclopropylbenzenesulfonamide
PubChem CID79465932
Molecular FormulaC14H20N2O3S
Molecular Weight296.39 g/mol
Exact Mass296.12
IUPAC Name2-(3-aminocyclopentyl)oxy-N-cyclopropylbenzenesulfonamide
SMILESNC1CCC(Oc2ccccc2S(=O)(=O)NC2CC2)C1
InChIInChI=1S/C14H20N2O3S/c15-10-5-8-12(9-10)19-13-3-1-2-4-14(13)20(17,18)16-11-6-7-11/h1-4,10-12,16H,5-9,15H2
InChIKeyVUIAAMAVKKWBCP-UHFFFAOYSA-N
XLogP1.39
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.39
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-aminocyclopentyl)oxy-N-cyclopropylbenzenesulfonamide?
The IUPAC name of 2-(3-aminocyclopentyl)oxy-N-cyclopropylbenzenesulfonamide (CID 79465932) is 2-(3-aminocyclopentyl)oxy-N-cyclopropylbenzenesulfonamide.
What is the SMILES notation for 2-(3-aminocyclopentyl)oxy-N-cyclopropylbenzenesulfonamide?
The canonical SMILES for 2-(3-aminocyclopentyl)oxy-N-cyclopropylbenzenesulfonamide is NC1CCC(Oc2ccccc2S(=O)(=O)NC2CC2)C1.
What is the InChIKey of 2-(3-aminocyclopentyl)oxy-N-cyclopropylbenzenesulfonamide?
The InChIKey is VUIAAMAVKKWBCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3S/c15-10-5-8-12(9-10)19-13-3-1-2-4-14(13)20(17,18)16-11-6-7-11/h1-4,10-12,16H,5-9,15H2.
What are the key properties of 2-(3-aminocyclopentyl)oxy-N-cyclopropylbenzenesulfonamide?
2-(3-aminocyclopentyl)oxy-N-cyclopropylbenzenesulfonamide has a molecular weight of 296.39 g/mol, XLogP of 1.39, 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-cyclopropylbenzenesulfonamide is sourced from PubChem (CID 79465932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).