1-Benzyl-4-(phenylamino)piperidine

C₁₈H₂₂N₂CAS 1155-56-2266.39 g/mol

Open in Covalent MOL file

Secondary amine Tertiary amine

Properties

Molecular formula: C₁₈H₂₂N₂
Molar mass: 266.39 g/mol
Exact mass: 266.1783 Da
Melting point: 848–886 °C
logP: 3.76Crippen estimate
Polar surface area: 15.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 4

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H315 Causes skin irritation97.9% of notifiers
H319 Causes serious eye irritation97.9% of notifiers
H335 May cause respiratory irritation97.9% of notifiers
H413 May cause long lasting harmful effects to aquatic life83% of notifiers

Aggregated from 47 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

1155-56-2

SMILES

c1ccc(CN2CCC(Nc3ccccc3)CC2)cc1

InChIKey

FSXGJIFBTBJMHV-UHFFFAOYSA-N

InChI

InChI=1S/C18H22N2/c1-3-7-16(8-4-1)15-20-13-11-18(12-14-20)19-17-9-5-2-6-10-17/h1-10,18-19H,11-15H2

Weigh it out

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

Names and synonyms

7 names

4-Piperidinamine, N-phenyl-1-(phenylmethyl)-
Piperidine, 4-anilino-1-benzyl-
N-Phenyl-1-(phenylmethyl)-4-piperidinamine
4-Anilino-1-benzylpiperidine
1-Benzyl-4-anilinopiperidine
NSC 76613
1-Benzyl-N-phenylpiperidin-4-amine

Work with 1-Benzyl-4-(phenylamino)piperidine

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

N-Methyl-1-(phenylmethyl)-4-piperidinamine7006-50-069 % similar (3S)-(+)-1-Benzyl-3-(methylamino)pyrrolidine169749-99-960 % similar 1-Benzylpiperidin-4-ol4727-72-458 % similar 1-Benzyl-4-piperidylamine50541-93-058 % similar 1-Benzyl-4-chloropiperidine67848-71-958 % similar 1,4,7,10-Tetrabenzyl-1,4,7,10-tetraazacyclododecane18084-64-557 % similar N-Cyclohexylbenzenamine1821-36-955 % similar (3S)-1-(Phenylmethyl)-3-pyrrolidinol101385-90-454 % similar

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

Same formula

4,4′-Cyclohexylidenebis[benzenamine]3282-99-3 Cyclizine82-92-8

Elsewhere

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