2-Aminoadenosine

C10H14N6O4CAS 2096-10-8282.26 g/mol

Open in Covalent MOL file
NHNNNOOHOHOHH2NHN
AlcoholEtherPrimary amine

Properties

Molecular formula
C10H14N6O4
Molar mass
282.26 g/mol
Exact mass
282.1077 Da
Melting point
248 °C
logP
-2.57Crippen estimate
Polar surface area
166.3 Ų
H-bond donors / acceptors
6 / 8
Rotatable bonds
2
Stereocentres
R, R, S, Rin SMILES atom order

Hazards

Warning
Irritant (GHS07)

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
2096-10-8
SMILES
N=c1nc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(N)[nH]1
InChIKey
ZDTFMPXQUSBYRL-UUOKFMHZSA-N
InChI
InChI=1S/C10H14N6O4/c11-7-4-8(15-10(12)14-7)16(2-13-4)9-6(19)5(18)3(1-17)20-9/h2-3,5-6,9,17-19H,1H2,(H4,11,12,14,15)/t3-,5-,6-,9-/m1/s1

Weigh it out

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

Names and synonyms

13 names · show all
  • Adenosine, 2-amino-
  • 9H-Purine, 2,6-diamino-9-β-D-ribofuranosyl-
  • 2,6-Diaminopurine riboside
  • 9-β-Ribosyl-2,6-diaminopurine
  • 2,6-Diaminopurine ribonucleoside
  • 9H-Purine-2,6-diamine, 9-β-D-ribofuranosyl-
  • 2,6-Diaminonebularine
  • 2,6-Diaminopurinosine
  • 2,6-Diamino-9-β-D-ribofuranosylpurine
  • NSC 7363
  • 18: PN: US7015315 PAGE: 27 claimed sequence
  • 2-(2,6-Diaminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
  • 5-(2,6-Diaminopurin-9-yl)-2-(hydroxymethyl)oxolane-3,4-diol

Work with 2-Aminoadenosine

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-Amino-3′-O-methyladenosine80791-88-480 % similar 2-Amino-6-chloropurine riboside2004-07-175 % similar 2-Thioadenosine43157-50-275 % similar 2-Amino-2′-deoxyadenosine4546-70-767 % similar Guanosine118-00-364 % similar 9-Beta-D-arabinofuranosylguanine38819-10-264 % similar Guanosine85-30-364 % similar Thioguanosine85-31-464 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook