2-(Aminomethyl)-N,N-dipropylaniline

C₁₃H₂₂N₂CAS 1020969-90-7206.33 g/mol

Open in Covalent MOL file

Primary amine Tertiary amine

Properties

Molecular formula: C₁₃H₂₂N₂
Molar mass: 206.33 g/mol
Exact mass: 206.1783 Da
logP: 2.77Crippen estimate
Polar surface area: 29.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 6

Identifiers

CAS number

1020969-90-7

SMILES

CCCN(CCC)C1=CC=CC=C1CN

InChIKey

GDBFJUXFXKOKBL-UHFFFAOYSA-N

InChI

InChI=1S/C13H22N2/c1-3-9-15(10-4-2)13-8-6-5-7-12(13)11-14/h5-8H,3-4,9-11,14H2,1-2H3

Weigh it out

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

Work with 2-(Aminomethyl)-N,N-dipropylaniline

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-butyl-N-methylaniline1020988-06-061 % similar 2-[2-(Aminomethyl)(ethyl)anilino]-1-ethanol1178469-53-859 % similar 1-[2-(Aminomethyl)phenyl]-3-pyrrolidinol1220033-92-051 % similar [2-(2-Ethyl-1-piperidinyl)phenyl]methanamine1094828-99-548 % similar 2-(Aminomethyl)-N-cyclohexyl-N-ethylaniline1021237-25-148 % similar 1-(2-Ethylphenyl)piperazine40224-10-046 % similar 2-Methylbenzylamine89-93-042 % similar [2-(4-Methylpiperazin-1-yl)phenyl]methanol123987-12-241 % similar

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

Same formula

N,N'-Dicyclohexylcarbodiimide538-75-0 N-Octyl-4-pyridinamine64690-19-3

Elsewhere

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