Molecule record

3-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-9-hydroxy-2-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one

C₂₃H₂₇FN₄O₃

426.49 g/mol

Loading structure

Molecular properties

Formula: C₂₃H₂₇FN₄O₃
Molar mass: 426.49 g·mol⁻¹
Exact mass: 426.2067 Da
: 12
PubChem CID: 115237

Functional groups

Alcohol

Alkane / alkyl carbon

Aromatic ring

Aryl halide

Tertiary amine

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

144598-75-4
838F01T721
9 Hydroxy risperidone
9 OH risperidone
9-Hydroxyrisperidone
C23H27FN4O3
CHEBI:82978
CHEMBL1621

Show all 24 synonyms

DTXCID30210372
DTXSID7049059
Invega
MFCD00871802
N05AX13
NSC-759623
Paliperidona
Paliperidone
Paliperidone [INN]
R-76477
R76477
RO-76477
RO76477
RefChem:56592
Trevicta
paliperidonum

Structure identifiers

Canonical SMILES: Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2O
Isomeric SMILES: CC1=C(C(=O)N2CCCC(C2=N1)O)CCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)F
InChI: InChI=1S/C23H27FN4O3/c1-14-17(23(30)28-9-2-3-19(29)22(28)25-14)8-12-27-10-6-15(7-11-27)21-18-5-4-16(24)13-20(18)31-26-21/h4-5,13,15,19,29H,2-3,6-12H2,1H3
InChIKey: PMXMIIMHBWHSKN-UHFFFAOYSA-N
PubChem CID: 115237

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library

No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for 3-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-9-hydroxy-2-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 3-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-9-hydroxy-2-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

PubChem(link only)

Open source record