2-(1-Benzylpiperidin-4-yl)ethan-1-amine

C14H22N2CAS 86945-25-7218.34 g/mol

Open in Covalent MOL file
NH2N
Primary amineTertiary amine

Properties

Molecular formula
C14H22N2
Molar mass
218.34 g/mol
Exact mass
218.1783 Da
logP
2.25Crippen estimate
Polar surface area
29.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
4

Hazards

Danger
Corrosive (GHS05)Acute Toxic (GHS06)

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P270, P280, P301+P316, P305+P354+P338, P317, P321, P330, P405, P501

Identifiers

CAS number
86945-25-7
SMILES
C1CN(CCC1CCN)CC2=CC=CC=C2
InChIKey
OUYRPOHWEJUTCQ-UHFFFAOYSA-N
InChI
InChI=1S/C14H22N2/c15-9-6-13-7-10-16(11-8-13)12-14-4-2-1-3-5-14/h1-5,13H,6-12,15H2

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Names and synonyms

1 names
  • 4-(2-Aminoethyl)-1-benzylpiperidine

Work with 2-(1-Benzylpiperidin-4-yl)ethan-1-amine

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

(1-Benzyl-4-piperidinyl)methylamine88915-26-872 % similar (1-Benzylpyrrolidin-3-yl)methanamine93138-61-563 % similar 1-(2-Aminoethyl)-4-benzylpiperazine4553-21-363 % similar 1-(Phenylmethyl)-4-piperidinemethanol67686-01-562 % similar 1-Benzyl-4-piperidylamine50541-93-061 % similar 1-Benzylpiperidin-4-ol4727-72-456 % similar 1-Benzyl-4-chloropiperidine67848-71-956 % similar 1-Benzylpiperidin-4-amine dihydrochloride1205-72-756 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

[2-(2-Ethyl-1-piperidinyl)phenyl]methanamine1094828-99-5 (3R,4R)-1-Benzyl-N,4-dimethylpiperidin-3-amine477600-70-7 2-(Aminomethyl)-N-cyclohexyl-N-methylaniline893752-73-3

Elsewhere

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