chempirical

Isopentenyladenine

C10H13N5CAS 2365-40-4203.25 g/mol

Open in Covalent MOL file
HNNNHNN
AlkeneSecondary amine

Properties

Molecular formula
C10H13N5
Molar mass
203.25 g/mol
Exact mass
203.1171 Da
Melting point
218–220 °C
logP
1.68Crippen estimate
Polar surface area
66.5 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
3

Identifiers

CAS number
2365-40-4
SMILES
CC(C)=CCNc1nc[nH]c2ncnc1-2
InChIKey
HYVABZIGRDEKCD-UHFFFAOYSA-N
InChI
InChI=1S/C10H13N5/c1-7(2)3-4-11-9-8-10(13-5-12-8)15-6-14-9/h3,5-6H,4H2,1-2H3,(H2,11,12,13,14,15)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

25 names · show all
  • N6-(δ2-Isopentenyl)aminopurine
  • 6-(δ2-Isopentenylamino)purine
  • N6-(γ,γ-Dimethylallyl)aminopurine
  • 6-Isopentenyladenine
  • N-(3-Methyl-2-butenyl)-1H-purin-6-amine
  • IPA
  • Bryokinin
  • DMAA
  • NSC 106958
  • Enadenine
  • N6-Isopentenyladenine
  • 9H-Purin-6-amine, N-(3-methyl-2-buten-1-yl)-
  • Adenine, N-(3-methyl-2-butenyl)-
  • 1H-Purin-6-amine, N-(3-methyl-2-butenyl)-
  • N-(3-Methyl-2-buten-1-yl)-9H-purin-6-amine
  • 6-(γ,γ-Dimethylallylamino)purine
  • 6-N-(3-Methylbut-2-enylamino)purine
  • N-(γ,γ-Dimethylallyl)adenine
  • N6-(2-Isopentenyl)adenine
  • N6-(3-Methyl-2-butenyl)adenine
  • 2Ip
  • N6-(δ2-Isopentenyl)adenine
  • 6-(3-Methyl-2-buten-1-ylamino)purine
  • N-(3-Methyl-2-butenyl)adenine
  • 6-[(3-Methyl-2-butenyl)amino]purine

Work with Isopentenyladenine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Methyl-4-(9H-purin-6-ylamino)-2-buten-1-ol13114-27-773 % similar Zeatin1637-39-473 % similar 6-Benzylaminopurine1214-39-751 % similar Kinetin525-79-147 % similar Adenine73-24-539 % similar 6-Bromo-9H-purine767-69-139 % similar 6-Chloropurine87-42-339 % similar Adenine hydrochloride2922-28-336 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook