Molecular Identity
Risperidone
3-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-2-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
PubChem CID: 5073
Risperidone is a member of the class of pyridopyrimidines that is 2-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one carrying an additional 2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl group at position 2. It has a role as a psychotropic drug, an alpha-adrenergic antagonist, a H1-receptor antagonist, a serotonergic antagonist, a dopaminergic antagonist, a second generation antipsychotic and an EC 3.4.21.26 (prolyl oligopeptidase) inhibitor. It is an organofluorine compound, a pyridopyrimidine, a heteroarylpiperidine and a member of 1,2-benzoxazoles.
2D Structure
Properties
C23H27FN4O2
Molecular Formula
410.50
Molecular Weight
g/mol
410.2118
Exact Mass
Da
2.7
XLogP
Drug-like (Lipinski: < 5)
61.9
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
6
H-Bond Acceptors
731
Complexity
SMILES
Canonical SMILES
SMILES: CC1=C(C(=O)N2CCCCC2=N1)CCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)FIsomeric SMILES
SMILES: CC1=C(C(=O)N2CCCCC2=N1)CCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)FSynonyms(20)
risperidone106266-06-2RisperdalRisperdal ConstaRispoleptRispolinRisperinSequinanRisperidonaRisperidal M-TabRisperidonumRisperdal M-TabSpironPerserisR 64 766
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Risperidone
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