Molecule record

2-amino-9-(2-hydroxyethoxymethyl)-1H-purin-6-one

C8H11N5O3

225.21 g/mol

Loading structure

Molecular properties

Formula
C8H11N5O3
Molar mass
225.21 g·mol−1
Exact mass
225.0862 Da
6
PubChem CID
135398513

Functional groups

Alcohol
Alkane / alkyl carbon
Aromatic ring
Ether
Primary amine

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 2-Amino-1,9-dihydro-9-((2-hydroxyethoxy)methyl)-6H-purin-6-one
  • 2-Amino-9-[(2-hydroxyethoxy)methyl]-1,9-dihydro-6H-purin-6-one
  • 59277-89-3
  • 6H-Purin-6-one, 2-amino-1,9-dihydro-9-[(2-hydroxyethoxy)methyl]-
  • 9-[(2-Hydroxyethoxy)methyl]guanine
  • Acicloftal
  • Aciclovir
  • Aciclovirum
Show all 24 synonyms
  • Aciclovirum [Latin]
  • Acycloguanosine
  • BW-248U
  • CHEBI:2453
  • Cargosil
  • Cyclovir
  • DTXSID1022556
  • Gerpevir
  • NSC-758477
  • Novirus
  • Sitavig
  • Vipral
  • Virorax
  • Wellcome-248U
  • X4HES1O11F
  • acyclovir

Structure identifiers

Canonical SMILES
Nc1nc2c(ncn2COCCO)c(=O)[nH]1
Isomeric SMILES
C1=NC2=C(N1COCCO)N=C(NC2=O)N
InChI
InChI=1S/C8H11N5O3/c9-8-11-6-5(7(15)12-8)10-3-13(6)4-16-2-1-14/h3,14H,1-2,4H2,(H3,9,11,12,15)
InChIKey
MKUXAQIIEYXACX-UHFFFAOYSA-N
PubChem CID
135398513

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for 2-amino-9-(2-hydroxyethoxymethyl)-1H-purin-6-one; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 2-amino-9-(2-hydroxyethoxymethyl)-1H-purin-6-one; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

Open source record