chempirical

N-Methyl-γ-phenylbenzenepropanamine

C16H19NCAS 28075-29-8225.34 g/mol

Open in Covalent MOL file
NH
Secondary amine

Properties

Molecular formula
C16H19N
Molar mass
225.34 g/mol
Exact mass
225.1517 Da
Boiling point
178 °C (at 10 Torr)
logP
3.43Crippen estimate
Polar surface area
12.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
5

Identifiers

CAS number
28075-29-8
SMILES
CNCCC(c1ccccc1)c1ccccc1
InChIKey
AKEGHAUFMKCWGX-UHFFFAOYSA-N
InChI
InChI=1S/C16H19N/c1-17-13-12-16(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,16-17H,12-13H2,1H3

Weigh it out

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

Names and synonyms

4 names
  • Benzenepropanamine, N-methyl-γ-phenyl-
  • Propylamine, N-methyl-3,3-diphenyl-
  • N-Methyl-3,3-diphenylpropylamine
  • (3,3-Diphenylpropyl)methylamine

Work with N-Methyl-γ-phenylbenzenepropanamine

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

3-(Methylamino)-1-phenyl-1-propanol42142-52-963 % similar N-Methylphenethylamine589-08-250 % similar Atomoxetine83015-26-350 % similar 1,1′-Hexylidenebis[benzene]1530-04-748 % similar γ-Phenylbenzenepropanol20017-67-848 % similar 3,3-Diphenylpropyl bromide20017-68-948 % similar 3,3-Diphenylpropylamine5586-73-248 % similar 1,1-Diphenylpropane1530-03-646 % similar

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

Same formula

N-Ethyl-N-(3-methylphenyl)benzenemethanamine119-94-8 4-[trans-4-(1E)-1-Propen-1-ylcyclohexyl]benzonitrile96184-40-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook