2-Piperidino-4-(trifluoromethyl)pyridine

HCID 11368200

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Basic information

CAS: 220459-54-1
Standard SMILES: FC(F)(F)c1ccnc(N2CCCCC2)c1
InChIKey: JTBLXSFBLWJCTD-UHFFFAOYSA-N
Molecular formula: C11H13F3N2
Average molar mass: 230.23 g/mol
Monoisotopic mass: 230.10308291

Names & identifiers

Preferred name: 2-Piperidino-4-(trifluoromethyl)pyridine
IUPAC: 2-piperidin-1-yl-4-(trifluoromethyl)pyridine

Names & synonyms

2-Piperidino-4-(trifluoromethyl)pyridine2-(piperidin-1-yl)-4-(trifluoromethyl)pyridineSCHEMBL1998032SCHEMBL24008459JTBLXSFBLWJCTD-UHFFFAOYSA-NDTXSID801252462220459-54-12-(1-Piperidinyl)-4-(trifluoromethyl)pyridine

Database identifiers

CAS: 220459-54-1
PubChem CID: 11368200
DTXSID: DTXSID801252462
Nikkaji: J1.071.773F

Properties

Computed structural properties

XLogP: 3
Topological polar surface area: 16.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 5
Rotatable bonds: 1
Heavy atoms: 16
Formal charge: 0
Complexity: 224

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