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3-Methyl-1-[5-(trifluoromethyl)-2-pyridinyl]piperidin-4-ol (HCID 23159129)｜Huagongshe

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Compound

3-Methyl-1-[5-(trifluoromethyl)-2-pyridinyl]piperidin-4-ol

HCID 23159129

Notes Reactions

Basic information Names & identifiers Properties Related reactions Compound notes

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Basic information

Standard SMILES: CC1CN(c2ccc(C(F)(F)F)cn2)CCC1O
InChIKey: WDVXCIJLJXBWGW-UHFFFAOYSA-N
Molecular formula: C12H15F3N2O
Average molar mass: 260.26 g/mol

Names & identifiers

Preferred name: 3-Methyl-1-[5-(trifluoromethyl)-2-pyridinyl]piperidin-4-ol
IUPAC: 3-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]piperidin-4-ol

Names & synonyms

SCHEMBL384718

Database identifiers

PubChem CID: 23159129

Properties

Computed structural properties

XLogP: 2.5
Topological polar surface area: 36.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 6
Rotatable bonds: 1
Heavy atoms: 18
Formal charge: 0
Complexity: 285

Related reactions

1 records

New reaction record

HRID 146019 reaction equation

HRID 146019As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)

Compound notes

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