chempirical

2-O-Methylcytosine

C5H7N3OCAS 3289-47-2125.13 g/mol

Open in Covalent MOL file
ONNHHN
Ether

Properties

Molecular formula
C5H7N3O
Molar mass
125.13 g/mol
Exact mass
125.0589 Da
Melting point
174 °C
logP
-0.10Crippen estimate
Polar surface area
61.8 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
1

Identifiers

CAS number
3289-47-2
SMILES
COc1nccc(=N)[nH]1
InChIKey
DHYLZDVDOQLEAQ-UHFFFAOYSA-N
InChI
InChI=1S/C5H7N3O/c1-9-5-7-3-2-4(6)8-5/h2-3H,1H3,(H2,6,7,8)

Weigh it out

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

Names and synonyms

5 names
  • 4-Pyrimidinamine, 2-methoxy-
  • Pyrimidine, 4-amino-2-methoxy-
  • 2-Methoxy-4-pyrimidinamine
  • 2-Methoxycytosine
  • 4-Amino-2-methoxypyrimidine

Work with 2-O-Methylcytosine

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-Thiocytosine333-49-347 % similar Cytosine71-30-747 % similar 4-Bromo-2-methoxypyridine100367-39-336 % similar 2-Amino-4-methoxypyridine10201-73-736 % similar 2-Amino-4-methoxy-6-methyl-1,3,5-triazine1668-54-836 % similar 2-Chloro-4-methoxypyridine17228-69-236 % similar 2-Methoxypyridin-4-amine20265-39-836 % similar 2-Amino-4,6-dimethoxypyrimidine256642-28-134 % similar

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

Same formula

2-Amino-5-pyrimidinemethanol120747-85-5 2-Amino-5-methoxypyrimidine13418-77-4 4-Methoxy-2-pyrimidinamine155-90-8 2-Amino-4-hydroxy-6-methylpyrimidine3977-29-5 5-Methylcytosine554-01-8 6-Methoxy-4-pyrimidinamine696-45-7 3-Amino-6-methoxypyridazine7252-84-8 6-Amino-2-methyl-4(3H)-pyrimidinone767-16-8

Elsewhere

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