Ropinirole Hydrochloride

C16H25ClN2O — CID 68727

IUPAC4-[2-(dipropylamino)ethyl]-1,3-dihydroindol-2-one;hydrochloride
SMILESCCCN(CCC)CCC1=C2CC(=O)NC2=CC=C1.Cl
InChIInChI=1S/C16H24N2O.ClH/c1-3-9-18(10-4-2)11-8-13-6-5-7-15-14(13)12-16(19)17-15;/h5-7H,3-4,8-12H2,1-2H3,(H,17,19);1H
InChIKeyXDXHAEQXIBQUEZ-UHFFFAOYSA-N
MW296.83 g/mol
LogP—
Rot. Bonds7

About Ropinirole Hydrochloride

Ropinirole Hydrochloride (PubChem CID 68727) has the molecular formula C16H25ClN2O and a molecular weight of 296.83 g/mol. Its IUPAC name is 4-[2-(dipropylamino)ethyl]-1,3-dihydroindol-2-one;hydrochloride.

Molecular Properties

Compound NameRopinirole Hydrochloride
PubChem CID68727
Molecular FormulaC16H25ClN2O
Molecular Weight296.83 g/mol
Exact Mass296.17
IUPAC Name4-[2-(dipropylamino)ethyl]-1,3-dihydroindol-2-one;hydrochloride
SMILESCCCN(CCC)CCC1=C2CC(=O)NC2=CC=C1.Cl
InChIInChI=1S/C16H24N2O.ClH/c1-3-9-18(10-4-2)11-8-13-6-5-7-15-14(13)12-16(19)17-15;/h5-7H,3-4,8-12H2,1-2H3,(H,17,19);1H
InChIKeyXDXHAEQXIBQUEZ-UHFFFAOYSA-N
XLogP—
TPSA32.30 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity286

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Ropinirole
CID 5095
Oxindole
CID 321710
(3Z)-3-[[4-(dimethylamino)phenyl]methylidene]-1H-indol-2-one
CID 6450842
N-Methyloxindole
CID 6096
N-Ethyloxindole
CID 66135
5-fluoro-1,3-dihydro-2H-indol-2-one
CID 3731012
DR-4004
CID 9843179
3-Methyloxindole
CID 150923
3-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-N-o-tolyl-propionamide
CID 721309
3-((3,4-Dimethylphenyl)imino)-1,3-dihydro-2H-indol-2-one
CID 135406017
3-Benzyl-1,3-dihydroindol-2-one
CID 347328
(3E)-3-(3-methylbut-2-enylidene)-1H-indol-2-one
CID 5319526

Frequently Asked Questions

What is the IUPAC name of Ropinirole Hydrochloride?
The IUPAC name of Ropinirole Hydrochloride (CID 68727) is 4-[2-(dipropylamino)ethyl]-1,3-dihydroindol-2-one;hydrochloride.
What is the SMILES notation for Ropinirole Hydrochloride?
The canonical SMILES for Ropinirole Hydrochloride is CCCN(CCC)CCC1=C2CC(=O)NC2=CC=C1.Cl.
What is the InChIKey of Ropinirole Hydrochloride?
The InChIKey is XDXHAEQXIBQUEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O.ClH/c1-3-9-18(10-4-2)11-8-13-6-5-7-15-14(13)12-16(19)17-15;/h5-7H,3-4,8-12H2,1-2H3,(H,17,19);1H.
What are the key properties of Ropinirole Hydrochloride?
Ropinirole Hydrochloride has a molecular weight of 296.83 g/mol, XLogP of not available, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for Ropinirole Hydrochloride is sourced from PubChem (CID 68727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).