Rasagiline (Standard)

Chemical Information
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.
| CAS Number | 136236-51-6 |
| PubChem CID | 3052776 |
| IUPAC Name | (1R)-N-prop-2-ynyl-2,3-dihydro-1H-inden-1-amine |
| Molecular Formula | C12H13N |
| Molecular Weight | 171.24 |
| XLogP | 1.8 |
| Topological Polar Surface Area | 12 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 2 |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 212 |
| Property | Value |
|---|---|
| Molecular Weight | 171.24 |
| XLogP3 | 1.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 2 |
| Exact Mass | 171.104799419 |
| Monoisotopic Mass | 171.104799419 |
| Topological Polar Surface Area | 12 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 212 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
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