{2-[3,4-Dihydro-2(1H)-isoquinolinyl]-phenyl}methanamine

C₁₆H₁₈N₂CAS 937599-97-8238.33 g/mol

Open in Covalent MOL file

Primary amine Tertiary amine

Properties

Molecular formula: C₁₆H₁₈N₂
Molar mass: 238.33 g/mol
Exact mass: 238.1470 Da
logP: 2.71Crippen estimate
Polar surface area: 29.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 2

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

937599-97-8

SMILES

C1CN(CC2=CC=CC=C21)C3=CC=CC=C3CN

InChIKey

WBSKZNLYVGHPLH-UHFFFAOYSA-N

InChI

InChI=1S/C16H18N2/c17-11-14-6-3-4-8-16(14)18-10-9-13-5-1-2-7-15(13)12-18/h1-8H,9-12,17H2

Weigh it out

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Work with {2-[3,4-Dihydro-2(1H)-isoquinolinyl]-phenyl}methanamine

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,N-dipropylaniline1020969-90-757 % similar 2-(Aminomethyl)-N,N-diethylaniline334009-12-056 % similar 2-[2-(Aminomethyl)(ethyl)anilino]-1-ethanol1178469-53-850 % similar 1-[2-(Aminomethyl)phenyl]-3-pyrrolidinol1220033-92-050 % similar 2-[2-(Aminomethyl)(methyl)anilino]-1-ethanol643087-97-245 % similar 2-(Aminomethyl)-N-butyl-N-methylaniline1020988-06-044 % similar 2-(Aminomethyl)-N-cyclohexyl-N-methylaniline893752-73-340 % similar [2-(2-Ethyl-1-piperidinyl)phenyl]methanamine1094828-99-540 % similar

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

Same formula

1-(3-Biphenylyl)piperazine115761-61-0 1-Biphenyl-4-yl-piperazine180698-19-5 1-(Diphenylmethyl)-3-azetidinamine40432-52-8

Elsewhere

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