2-(Aminomethyl)-N-cyclohexyl-N-methylaniline

C₁₄H₂₂N₂CAS 893752-73-3218.34 g/mol

Open in Covalent MOL file

Primary amine Tertiary amine

Properties

Molecular formula: C₁₄H₂₂N₂
Molar mass: 218.34 g/mol
Exact mass: 218.1783 Da
logP: 2.91Crippen estimate
Polar surface area: 29.3 Å²
H-bond donors / acceptors: 1 / 2
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

893752-73-3

SMILES

CN(C1CCCCC1)C2=CC=CC=C2CN

InChIKey

YWSIVBBGUDOXHB-UHFFFAOYSA-N

InChI

InChI=1S/C14H22N2/c1-16(13-8-3-2-4-9-13)14-10-6-5-7-12(14)11-15/h5-7,10,13H,2-4,8-9,11,15H2,1H3

Weigh it out

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

Work with 2-(Aminomethyl)-N-cyclohexyl-N-methylaniline

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

2-(Aminomethyl)-N-cyclohexyl-N-ethylaniline1021237-25-166 % similar 2-(Aminomethyl)-N-butyl-N-methylaniline1020988-06-048 % similar 2-(Aminomethyl)-N,N-diethylaniline334009-12-047 % similar 2-[2-(Aminomethyl)(methyl)anilino]-1-ethanol643087-97-245 % similar 2-(Aminomethyl)-N,N-dipropylaniline1020969-90-745 % similar 1-[2-(Aminomethyl)phenyl]-3-pyrrolidinol1220033-92-043 % similar 2-[2-(Aminomethyl)(ethyl)anilino]-1-ethanol1178469-53-840 % similar 2-Methylbenzylamine89-93-038 % 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-(1-Benzylpiperidin-4-yl)ethan-1-amine86945-25-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook