N-[3-(2-aminoethoxy)phenyl]cyclopropanesulfonamide

C11H16N2O3S — CID 64554905

IUPACN-[3-(2-aminoethoxy)phenyl]cyclopropanesulfonamide
SMILESNCCOc1cccc(NS(=O)(=O)C2CC2)c1
InChIInChI=1S/C11H16N2O3S/c12-6-7-16-10-3-1-2-9(8-10)13-17(14,15)11-4-5-11/h1-3,8,11,13H,4-7,12H2
InChIKeyULHJRGUYFCLJNJ-UHFFFAOYSA-N
MW256.33 g/mol
LogP0.93
Rot. Bonds6

About N-[3-(2-aminoethoxy)phenyl]cyclopropanesulfonamide

N-[3-(2-aminoethoxy)phenyl]cyclopropanesulfonamide (PubChem CID 64554905) has the molecular formula C11H16N2O3S and a molecular weight of 256.33 g/mol. Its IUPAC name is N-[3-(2-aminoethoxy)phenyl]cyclopropanesulfonamide.

Molecular Properties

Compound NameN-[3-(2-aminoethoxy)phenyl]cyclopropanesulfonamide
PubChem CID64554905
Molecular FormulaC11H16N2O3S
Molecular Weight256.33 g/mol
Exact Mass256.09
IUPAC NameN-[3-(2-aminoethoxy)phenyl]cyclopropanesulfonamide
SMILESNCCOc1cccc(NS(=O)(=O)C2CC2)c1
InChIInChI=1S/C11H16N2O3S/c12-6-7-16-10-3-1-2-9(8-10)13-17(14,15)11-4-5-11/h1-3,8,11,13H,4-7,12H2
InChIKeyULHJRGUYFCLJNJ-UHFFFAOYSA-N
XLogP0.93
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.33
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[3-(2-aminoethoxy)phenyl]cyclopropanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-aminoethoxy)phenyl]cyclopropanesulfonamide?
The IUPAC name of N-[3-(2-aminoethoxy)phenyl]cyclopropanesulfonamide (CID 64554905) is N-[3-(2-aminoethoxy)phenyl]cyclopropanesulfonamide.
What is the SMILES notation for N-[3-(2-aminoethoxy)phenyl]cyclopropanesulfonamide?
The canonical SMILES for N-[3-(2-aminoethoxy)phenyl]cyclopropanesulfonamide is NCCOc1cccc(NS(=O)(=O)C2CC2)c1.
What is the InChIKey of N-[3-(2-aminoethoxy)phenyl]cyclopropanesulfonamide?
The InChIKey is ULHJRGUYFCLJNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3S/c12-6-7-16-10-3-1-2-9(8-10)13-17(14,15)11-4-5-11/h1-3,8,11,13H,4-7,12H2.
What are the key properties of N-[3-(2-aminoethoxy)phenyl]cyclopropanesulfonamide?
N-[3-(2-aminoethoxy)phenyl]cyclopropanesulfonamide has a molecular weight of 256.33 g/mol, XLogP of 0.93, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-aminoethoxy)phenyl]cyclopropanesulfonamide is sourced from PubChem (CID 64554905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).