Molindone

enlarge

Systematic / IUPAC Name: 3-Ethyl-2-methyl-5-(4-morpholinylmethyl)-1,5,6,7-tetrahydro-4H-indol-4-one

ID: Reference7333

Other Names: Molindona;
Molindonum;
3-Ethyl-1,5,6,7-tetrahydro-2-methyl-5-(4-morpholinylmethyl)-4H-indol-4-one;
3-Ethyl-2-methyl-5-(morpholin-4-ylmethyl)-1,5,6,7-tetrahydro-4H-indol-4-one;
3-Ethyl-2-methyl-5-(morpholin-4-ylmethyl)-1,5,6,7-tetrahydroindol-4-one ; more

Formula: C16H24N2O2

Class: Therapeutics/Prescription Drugs Sports Doping Drugs

Spectral Data

Molindone mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 279
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/5/2018 1:22:43 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C16H24N2O2/c1-3-13-11(2)17-14-5-4-12(16(19)15(13)14)10-18-6-8-20-9-7-18/h12,17H,3-10H2,1-2H3
InChI Key KLPWJLBORRMFGK-UHFFFAOYSA-N
Canonical SMILES CCC1=C(NC2=C1C(=O)C(CC2)CN3CCOCC3)C
CAS
Splash
Other Names Molindona;
Molindonum;
3-Ethyl-1,5,6,7-tetrahydro-2-methyl-5-(4-morpholinylmethyl)-4H-indol-4-one;
3-Ethyl-2-methyl-5-(morpholin-4-ylmethyl)-1,5,6,7-tetrahydro-4H-indol-4-one;
3-Ethyl-2-methyl-5-(morpholin-4-ylmethyl)-1,5,6,7-tetrahydroindol-4-one;
3-Ethyl-6,7-dihydro-2-methyl-5-(morpholinomethyl)indol-4(5H)-one;
4H-Indol-4-one, 3-ethyl-1,5,6,7-tetrahydro-2-methyl-5-(4-morpholinylmethyl)-;
Indol-4(5H)-one, 3-ethyl-6,7-dihydro-2-methyl-5-(morpholinomethyl)-

In Other Databases

Wikipedia Molindone
ChemSpider 22342
ChEBI CHEBI:6965
KEGG C07230; D08226
DrugBank DB01618
PubChem 23897
ChemIDPlus 007416344
ChEMBL CHEMBL460
HMDb HMDB15555