rasagiline
(1R)-N-prop-2-ynyl-2,3-dihydro-1H-inden-1-amine
Molecular Identity
rasagiline
(1R)-N-prop-2-ynyl-2,3-dihydro-1H-inden-1-amine
PubChem CID: 3052776
Rasagiline is an indane that consists of 1-aminoindane bearing an N-propargyl substituent. A selective, irreversible monoamine oxidase-B inhibitor. It has a role as an EC 1.4.3.4 (monoamine oxidase) inhibitor and a neuroprotective agent. It is a secondary amine, a member of indanes and a terminal acetylenic compound.
2D Structure
Properties
C12H13N
Molecular Formula
171.24
Molecular Weight
g/mol
171.1048
Exact Mass
Da
1.8
XLogP
Drug-like (Lipinski: < 5)
12
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
1
H-Bond Acceptors
212
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
rasagiline136236-51-6(R)-N-2-Propynyl-1-indanamineTV-1030Rasagilina(1R)-N-prop-2-ynyl-2,3-dihydro-1H-inden-1-amineNSC-759639(1R)-N-propargylindan-1-amine003N66TS6T(R)-Indan-1-yl-prop-2-ynyl-amine1H-Inden-1-amine, 2,3-dihydro-N-2-propynyl-, (1R)DTXSID3041112CHEBI:63620Agn-1135rasagilinum
Data from PubChem (NCBI)
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