2-Aminopyrimidine-5-carbaldehyde

C₅H₅N₃OCAS 120747-84-4123.11 g/mol

Open in Covalent MOL file

Aldehyde Primary amine

Properties

Molecular formula: C₅H₅N₃O
Molar mass: 123.11 g/mol
Exact mass: 123.0433 Da
logP: -0.13Crippen estimate
Polar surface area: 68.9 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 1

Identifiers

CAS number

120747-84-4

SMILES

C1=C(C=NC(=N1)N)C=O

InChIKey

DPOYRRAYGKTRAU-UHFFFAOYSA-N

InChI

InChI=1S/C5H5N3O/c6-5-7-1-4(3-9)2-8-5/h1-3H,(H2,6,7,8)

Weigh it out

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

Names and synonyms

1 names

2-Amino-5-pyrimidinecarboxyaldehyde

Work with 2-Aminopyrimidine-5-carbaldehyde

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

Pyrimidine-5-carboxaldehyde10070-92-548 % similar 6-Oxo-1,6-dihydropyridine-3-carboxaldehyde106984-91-243 % similar 6-Bromo-3-pyridinecarboxaldehyde149806-06-443 % similar 4-Aminobenzaldehyde556-18-341 % similar 3-Quinolinecarboxaldehyde13669-42-639 % similar 6-Methoxy-3-pyridinecarboxaldehyde65873-72-539 % similar 1,4-Benzenedicarboxaldehyde623-27-839 % similar Pyridine-4-carbaldehyde872-85-537 % similar

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

Same formula

Pyrazinamide98-96-4

Elsewhere

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