chempirical

N2,N2-Dimethylguanosine

C12H17N5O5CAS 2140-67-2311.30 g/mol

Open in Covalent MOL file
NNHONNOOHOHOHN
AlcoholEtherPhenolTertiary amine

Properties

Molecular formula
C12H17N5O5
Molar mass
311.30 g/mol
Exact mass
311.1230 Da
Melting point
235–236 °C (decomposes)
logP
-1.79Crippen estimate
Polar surface area
137.0 Ų
H-bond donors / acceptors
4 / 9
Rotatable bonds
3
Stereocentres
R, R, S, Rin SMILES atom order

Identifiers

CAS number
2140-67-2
SMILES
CN(C)c1nc(O)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1
InChIKey
RSPURTUNRHNVGF-IOSLPCCCSA-N
InChI
InChI=1S/C12H17N5O5/c1-16(2)12-14-9-6(10(21)15-12)13-4-17(9)11-8(20)7(19)5(3-18)22-11/h4-5,7-8,11,18-20H,3H2,1-2H3,(H,14,15,21)/t5-,7-,8-,11-/m1/s1

Weigh it out

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

Names and synonyms

4 names
  • Guanosine, N,N-dimethyl-
  • N,N-Dimethylguanosine
  • 2,2-Dimethylguanosine
  • 2-Dimethylamino-6-oxypurine riboside

Work with N2,N2-Dimethylguanosine

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

Xanthosine146-80-572 % similar Inosine58-63-965 % similar N6-Dimethyladenosine2620-62-463 % similar Isoguanosine1818-71-959 % similar (2R,3R,4S,5R)-2-(2,6-Dichloro-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol13276-52-357 % similar N2-Methylguanosine2140-77-456 % similar 2-Chloroadenosine146-77-056 % similar Guanosine118-00-356 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook