N-benzyl-N,N-dimethyl-1-phenylmethanaminium | SBID = 2446 | Compound | Custom Molecule

Struc Structure

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Molecular Properties

Interactions: 4
PubChem TPSA/Å2:
Ertl TPSA/Å2: 0.0
Hydrophilicity (PubChem XLogP):
Hydrophilicity (Cheng XLogP3): -1.48
Charge: 1.0
Number of H-Bond Donors: 0.0
Number of H-Bond Acceptors: 0.0
Number of Stereogenic Bonds (E/Z):
Number of Stereogenic Atoms (R/S):
3D Volume/Å3:
Sum Formula: C16H20N+
M / g/mol: 226.3367
Complexity:
Number of Conformers:

Identifiers

  • Tags: typical guest
  • Name: N-benzyl-N,N-dimethyl-1-phenylmethanaminium
  • Preferred Abbreviation: N-benzyl-N,N-dimethyl-1-phenylmethanaminium
  • IUPAC Name:
  • CAS:
  • CID: -1046
  • InChiKey: LNIYNESXCOYFPW-UHFFFAOYSA-N
  • InChi: InChI=1S/C16H20N/c1-17(2,13-15-9-5-3-6-10-15)14-16-11-7-4-8-12-16/h3-12H,13-14H2,1-2H3/q+1
  • CanoSmiles: C[N+](Cc1ccccc1)(Cc1ccccc1)C
  • IsoSmiles: C[N+](CC1=CC=CC=C1)(C)CC2=CC=CC=C2