N-benzyl-N-ethylethanaminium | SBID = 2658 | Compound | Custom Molecule

Struc Structure

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Molecular Properties

Interactions: 3
PubChem TPSA/Å2:
Ertl TPSA/Å2: 4.44
Hydrophilicity (PubChem XLogP):
Hydrophilicity (Cheng XLogP3): 2.71
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: C11H18N+
M / g/mol: 164.26732
Complexity:
Number of Conformers:

Identifiers

  • Tags: guest
  • Name: N-benzyl-N-ethylethanaminium
  • Preferred Abbreviation: N-benzyl-N-ethylethanaminium
  • IUPAC Name:
  • CAS:
  • CID: -1194
  • InChiKey: ZWRDBWDXRLPESY-UHFFFAOYSA-O
  • InChi: InChI=1S/C11H17N/c1-3-12(4-2)10-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3/p+1
  • CanoSmiles: CC[NH+](Cc1ccccc1)CC
  • IsoSmiles: CC[NH+](CC)CC1=CC=CC=C1