cylopenthylmethanaminium | SBID = 2516 | Compound | Custom Molecule

Struc Structure

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Molecular Properties

Interactions: 1
PubChem TPSA/Å2:
Ertl TPSA/Å2: 35.0
Hydrophilicity (PubChem XLogP):
Hydrophilicity (Cheng XLogP3): -3.85
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: C6H14N+
M / g/mol: 100.18206
Complexity:
Number of Conformers:

Identifiers

  • Tags: typical guest
  • Name: cylopenthylmethanaminium
  • Preferred Abbreviation: cylopenthylmethanaminium
  • IUPAC Name:
  • CAS:
  • CID: -1095
  • InChiKey: UBLYEVLMRSPMOG-UHFFFAOYSA-O
  • InChi: InChI=1S/C6H13N/c7-5-6-3-1-2-4-6/h6H,1-5,7H2/p+1
  • CanoSmiles: [NH3+]CC1CCCC1
  • IsoSmiles: [H][N+]([H])([H])CC1CCCC1