2-Diphenylmethylpiperidine hydrochloride

C₁₈H₂₂ClNCAS 5807-81-8287.83 g/mol

Open in Covalent MOL file

Secondary amine

Properties

Molecular formula: C₁₈H₂₂ClN
Molar mass: 287.83 g/mol
Exact mass: 287.1441 Da
logP: 4.38Crippen estimate
Polar surface area: 12.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 3

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

5807-81-8

SMILES

C1CCNC(C1)C(C2=CC=CC=C2)C3=CC=CC=C3.Cl

InChIKey

NTADPDIPKMRRQV-UHFFFAOYSA-N

InChI

InChI=1S/C18H21N.ClH/c1-3-9-15(10-4-1)18(16-11-5-2-6-12-16)17-13-7-8-14-19-17;/h1-6,9-12,17-19H,7-8,13-14H2;1H

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 2-Diphenylmethylpiperidine hydrochloride

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

(±)-Desoxypipradrol519-74-4Free base

Similar compounds

(2S)-2-(Diphenylmethyl)pyrrolidine119237-64-879 % similar (R)-(+)-2-(Diphenylmethyl)pyrrolidine22348-31-879 % similar Ritalin298-59-958 % similar 2-Phenylpiperidine3466-80-655 % similar α-Phenyl-2-piperidineacetic acid19395-41-651 % similar 2-Phenylpyrrolidine1006-64-047 % similar 4-Phenylpiperidine hydrochloride10272-49-846 % similar 2,2′-Bipiperidine531-67-945 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook