4-[3-(1-aminocyclopentyl)-1,2,4-oxadiazol-5-yl]-N-ethylbenzenesulfonamide;hydrochloride

C15H21ClN4O3S — CID 120854920

IUPAC4-[3-(1-aminocyclopentyl)-1,2,4-oxadiazol-5-yl]-N-ethylbenzenesulfonamide;hydrochloride
SMILESCCNS(=O)(=O)C1=CC=C(C=C1)C2=NC(=NO2)C3(CCCC3)N.Cl
InChIInChI=1S/C15H20N4O3S.ClH/c1-2-17-23(20,21)12-7-5-11(6-8-12)13-18-14(19-22-13)15(16)9-3-4-10-15;/h5-8,17H,2-4,9-10,16H2,1H3;1H
InChIKeyHLGPGVRLWVGDLU-UHFFFAOYSA-N
MW372.90 g/mol
LogP—
Rot. Bonds5

About 4-[3-(1-aminocyclopentyl)-1,2,4-oxadiazol-5-yl]-N-ethylbenzenesulfonamide;hydrochloride

4-[3-(1-aminocyclopentyl)-1,2,4-oxadiazol-5-yl]-N-ethylbenzenesulfonamide;hydrochloride (PubChem CID 120854920) has the molecular formula C15H21ClN4O3S and a molecular weight of 372.90 g/mol. Its IUPAC name is 4-[3-(1-aminocyclopentyl)-1,2,4-oxadiazol-5-yl]-N-ethylbenzenesulfonamide;hydrochloride.

Molecular Properties

Compound Name4-[3-(1-aminocyclopentyl)-1,2,4-oxadiazol-5-yl]-N-ethylbenzenesulfonamide;hydrochloride
PubChem CID120854920
Molecular FormulaC15H21ClN4O3S
Molecular Weight372.90 g/mol
Exact Mass372.10
IUPAC Name4-[3-(1-aminocyclopentyl)-1,2,4-oxadiazol-5-yl]-N-ethylbenzenesulfonamide;hydrochloride
SMILESCCNS(=O)(=O)C1=CC=C(C=C1)C2=NC(=NO2)C3(CCCC3)N.Cl
InChIInChI=1S/C15H20N4O3S.ClH/c1-2-17-23(20,21)12-7-5-11(6-8-12)13-18-14(19-22-13)15(16)9-3-4-10-15;/h5-8,17H,2-4,9-10,16H2,1H3;1H
InChIKeyHLGPGVRLWVGDLU-UHFFFAOYSA-N
XLogP—
TPSA119.00 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity493

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze 4-[3-(1-aminocyclopentyl)-1,2,4-oxadiazol-5-yl]-N-ethylbenzenesulfonamide;hydrochloride 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 4-[3-(1-aminocyclopentyl)-1,2,4-oxadiazol-5-yl]-N-ethylbenzenesulfonamide;hydrochloride?
The IUPAC name of 4-[3-(1-aminocyclopentyl)-1,2,4-oxadiazol-5-yl]-N-ethylbenzenesulfonamide;hydrochloride (CID 120854920) is 4-[3-(1-aminocyclopentyl)-1,2,4-oxadiazol-5-yl]-N-ethylbenzenesulfonamide;hydrochloride.
What is the SMILES notation for 4-[3-(1-aminocyclopentyl)-1,2,4-oxadiazol-5-yl]-N-ethylbenzenesulfonamide;hydrochloride?
The canonical SMILES for 4-[3-(1-aminocyclopentyl)-1,2,4-oxadiazol-5-yl]-N-ethylbenzenesulfonamide;hydrochloride is CCNS(=O)(=O)C1=CC=C(C=C1)C2=NC(=NO2)C3(CCCC3)N.Cl.
What is the InChIKey of 4-[3-(1-aminocyclopentyl)-1,2,4-oxadiazol-5-yl]-N-ethylbenzenesulfonamide;hydrochloride?
The InChIKey is HLGPGVRLWVGDLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O3S.ClH/c1-2-17-23(20,21)12-7-5-11(6-8-12)13-18-14(19-22-13)15(16)9-3-4-10-15;/h5-8,17H,2-4,9-10,16H2,1H3;1H.
What are the key properties of 4-[3-(1-aminocyclopentyl)-1,2,4-oxadiazol-5-yl]-N-ethylbenzenesulfonamide;hydrochloride?
4-[3-(1-aminocyclopentyl)-1,2,4-oxadiazol-5-yl]-N-ethylbenzenesulfonamide;hydrochloride has a molecular weight of 372.90 g/mol, XLogP of not available, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(1-aminocyclopentyl)-1,2,4-oxadiazol-5-yl]-N-ethylbenzenesulfonamide;hydrochloride is sourced from PubChem (CID 120854920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).