N2P

PENTANE-1,5-DIAMINE

Created: 2002-05-23
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count21
Chiral Atom Count0
Bond Count20
Aromatic Bond Count0
2D diagram of N2P
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Chemical Component Summary

NamePENTANE-1,5-DIAMINE
Systematic Name (OpenEye OEToolkits)pentane-1,5-diamine
FormulaC5 H14 N2
Molecular Weight102.178
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04NCCCCCN
SMILESCACTVS3.341NCCCCCN
SMILESOpenEye OEToolkits1.5.0C(CCN)CCN
Canonical SMILESCACTVS3.341 NCCCCCN
Canonical SMILESOpenEye OEToolkits1.5.0 C(CCN)CCN
InChIInChI1.03 InChI=1S/C5H14N2/c6-4-2-1-3-5-7/h1-7H2
InChIKeyInChI1.03 VHRGRCVQAFMJIZ-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank IDDB03854 
NameCadaverine
Groups experimental
DescriptionCadaverine is a foul-smelling diamine formed by bacterial decarboxylation of lysine.
Synonyms
  • 1,5-Pentanediamine
  • Pentamethylenediamine
  • Cadaverine
  • DAPE
  • 1,5-pentamethylenediamine
Categories
  • Amines
  • Biogenic Amines
  • Biogenic Polyamines
  • Diamines
  • Glycerophosphates
CAS number462-94-2

Drug Targets

NameTarget SequencePharmacological ActionActions
2-C-methyl-D-erythritol 4-phosphate cytidylyltransferaseMATTHLDVCAVVPAAGFGRRMQTECPKQYLSIGNQTILEHSVHALLAHPR...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
Pharos CHEMBL119296
PubChem 273
ChEMBL CHEMBL119296
ChEBI CHEBI:18127
CCDC/CSD QATWEN, IGUROU, GUXRAS, GUSRAO, RONSUI, BOBDOM, IVEQUW