1-Methyllysergic acid pyrrolidide structure

1-Methyllysergic acid pyrrolidide

[(6aR,9R)-4,7-dimethyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinolin-9-yl]-pyrrolidin-1-ylmethanone

Also Known As: 1-Methyllysergic acid pyrrolidide|MPD-75|D-1-Methyl lysergic acid pyrrolidide|4-25-00-00970 (Beilstein Handbook Reference)|Ergoline-8-beta-carboxylic acid, 9,10-didehydro-1,6-dimethyl-, pyrrolidide|1-(1,6-dimethyl-9,10-didehydro-ergoline-8-carbonyl)-pyrrolidine|(1,6-Dimethyl-9,10-didehydroergolin-8-yl)(pyrrolidin-1-yl)methanone|(1,6-Dimethyl-9,10-didehydroergolin-8beta-yl)(pyrrolidin-1-yl)methanone|1-[(9,10-Didehydro-1,6-dimethylergolin-8beta-yl)carbonyl]pyrrolidine|Pyrrolidine, 1-[(9,10-didehydro-1,6-dimethylergolin-8.beta.-yl)carbonyl]-|Pyrrolidine, 1-[[(8.beta.)-9,10-didehydro-1,6-dimethylergolin-8-yl]carbonyl]-|(4R,7R)-6,11-dimethyl-4-(pyrrolidine-1-carbonyl)-6,11-diazatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),2,9,12,14-pentaene

CAS: 7221-79-6
Molecular Formula C21H25N3O
Molecular Weight 335.19977 g/mol
LogP 2.7
Topological Polar Surface Area 28.5 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
Rotatable Bonds 1
Exact Mass 335.19977
Monoisotopic Mass 335.19977
Heavy Atoms 25
Complexity 582.0

Chemical Identifiers

CAS Number 7221-79-6
SMILES CN1C[C@@H](C=C2[C@H]1CC3=CN(C4=CC=CC2=C34)C)C(=O)N5CCCC5
InChIKey PWISINPCTJKXCA-DNVCBOLYSA-N

Product Overview

1-Methyllysergic acid pyrrolidide (CAS 7221-79-6), with molecular formula C21H25N3O and molecular weight 335.19977 g/mol. IUPAC: [(6aR,9R)-4,7-dimethyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinolin-9-yl]-pyrrolidin-1-ylmethanone.

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