Compound Summary
Compound Information
(-)-Quinpirole hydrochloride
Compound Name: | (-)-Quinpirole hydrochloride |
Compound CID: | 55397 |
Synonyms: | (-)-Quinpirole hydrochloride |
Iupac Name: | (4aR,8aR)-5-propyl-1,4,4a,6,7,8,8a,9-octahydropyrazolo[3,4-g]quinoline;hydrochloride |
InChI: | InChI=1S/C13H21N3.ClH/c1-2-5-16-6-3-4-10-7-12-11(8-13(10)16)9-14-15-12;/h9-10,13H,2-8H2,1H3,(H,14,15);1H/t10-,13-;/m1./s1 |
InChIKey: | HJHVRVJTYPKTHX-HTMVYDOJSA-N |
Canonical Smiles: | CCCN1CCCC2C1CC3=C(C2)NN=C3.Cl |
Isomeric Smiles: | CCCN1CCC[C@H]2[C@H]1CC3=C(C2)NN=C3.Cl |
Molecular Weight: | 255.79 |
Molecular Formula: | C13H22ClN3 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
(-)-Quinpirole hydrochloride
Molecular Weight: | 255.79 |
Molecular Formula: | C13H22ClN3 |
Hydrogen Bond Donor Count: | 2 |
Hydrogen Bond Acceptor Count: | 2 |
Rotatable Bond Count: | 2 |
Heavy Atom Count: | 17 |
Complexity: | 243 |
Synonyms
(-)-Quinpirole hydrochloride
Experimental Data
(-)-Quinpirole hydrochloride
Experimental Data Visualization
(-)-Quinpirole hydrochloride
Statistics Data
(-)-Quinpirole hydrochloride
Statistics Data Visualization
(-)-Quinpirole hydrochloride
