Cadaverine (fully protonated form) | SBID = 670 | Compound | Custom Molecule

Struc Structure

Molecular Properties

Interactions: 10
PubChem TPSA/Å2:
Ertl TPSA/Å2:
Hydrophilicity (PubChem XLogP):
Hydrophilicity (Cheng XLogP3):
Charge: 2.0
Number of H-Bond Donors: 2.0
Number of H-Bond Acceptors: 0.0
Number of Stereogenic Bonds (E/Z):
Number of Stereogenic Atoms (R/S):
3D Volume/Å3:
Sum Formula: C5H16N2++
M / g/mol: 104.19394
Complexity:
Number of Conformers:

Identifiers

  • Tags: cation, typical guest, charged
  • Name: Cadaverine (fully protonated form)
  • Preferred Abbreviation: Pentane-1,5-diammonium
  • IUPAC Name: Pentane-1,5-diamine
  • CAS: 462-94-2
  • CID: -174
  • InChiKey: VHRGRCVQAFMJIZ-UHFFFAOYSA-P
  • InChi: InChI=1S/C5H14N2/c6-4-2-1-3-5-7/h1-7H2/p+2
  • CanoSmiles: [NH3+]CCCCC[NH3+]
  • IsoSmiles: [NH3+]CCCCC[NH3+]