2-((4-Chlorophenyl)(4-piperidinyloxy)methyl)pyridine

C₁₇H₁₉ClN₂OCAS 122368-54-1302.80 g/mol

Open in Covalent MOL file

Aryl halide Ether Secondary amine

Properties

Molecular formula: C₁₇H₁₉ClN₂O
Molar mass: 302.80 g/mol
Exact mass: 302.1186 Da
logP: 3.59Crippen estimate
Polar surface area: 34.1 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 4

Identifiers

CAS number

122368-54-1

SMILES

C1CNCCC1OC(C2=CC=C(C=C2)Cl)C3=CC=CC=N3

InChIKey

OTZYADIPHOGUDN-UHFFFAOYSA-N

InChI

InChI=1S/C17H19ClN2O/c18-14-6-4-13(5-7-14)17(16-3-1-2-10-20-16)21-15-8-11-19-12-9-15/h1-7,10,15,17,19H,8-9,11-12H2

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Names and synonyms

1 names

2-[(4-Chlorophenyl)(4-piperidinyloxy)methyl]pyridine

Work with 2-((4-Chlorophenyl)(4-piperidinyloxy)methyl)pyridine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Bepotastine125602-71-356 % similar α-(4-Chlorophenyl)-2-pyridinemethanol27652-89-748 % similar Bepotastine besilate190786-44-847 % similar Carbinoxamine maleate3505-38-242 % similar Chlorpheniramine maleate113-92-840 % similar (-)-1-[(4-Chlorophenyl)phenylmethyl]piperazine130018-88-138 % similar (-)-1-[(4-Chlorophenyl)phenylmethyl]piperazine300543-56-038 % similar Norchlorcyclizine303-26-438 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

5-(Benzyloxy)tryptamine monohydrochloride52055-23-9 Pyronine92-32-0

Elsewhere

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