2-[2-(Aminomethyl)(methyl)anilino]-1-ethanol

C₁₀H₁₆N₂OCAS 643087-97-2180.25 g/mol

Open in Covalent MOL file

Alcohol Primary amine Tertiary amine

Properties

Molecular formula: C₁₀H₁₆N₂O
Molar mass: 180.25 g/mol
Exact mass: 180.1263 Da
logP: 0.57Crippen estimate
Polar surface area: 49.5 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 4

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

643087-97-2

SMILES

CN(CCO)C1=CC=CC=C1CN

InChIKey

SDLNERINWWHAQF-UHFFFAOYSA-N

InChI

InChI=1S/C10H16N2O/c1-12(6-7-13)10-5-3-2-4-9(10)8-11/h2-5,13H,6-8,11H2,1H3

Weigh it out

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Work with 2-[2-(Aminomethyl)(methyl)anilino]-1-ethanol

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-methylaniline1020988-06-065 % similar 2-[2-(Aminomethyl)(ethyl)anilino]-1-ethanol1178469-53-863 % similar 2-(Methylphenylamino)ethanol93-90-351 % similar 2-(Aminomethyl)-N,N-dipropylaniline1020969-90-750 % similar 2-(Aminomethyl)-N,N-diethylaniline334009-12-049 % similar 2-(Aminomethyl)-N-cyclohexyl-N-methylaniline893752-73-345 % similar 2-(N-Methyl-N-(2-pyridyl)amino)ethanol122321-04-445 % similar 1-[2-(Aminomethyl)phenyl]-3-pyrrolidinol1220033-92-044 % similar

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

Same formula

Rilmenidine54187-04-1

Elsewhere

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