chempirical

1-Methyl-1H-pyrazolo[3,4-B]pyridin-3-ylamine

C7H8N4CAS 72583-83-6148.17 g/mol

Open in Covalent MOL file
NNNNH2
Primary amine

Properties

Molecular formula
C7H8N4
Molar mass
148.17 g/mol
Exact mass
148.0749 Da
logP
0.55Crippen estimate
Polar surface area
56.7 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
72583-83-6
SMILES
CN1C2=C(C=CC=N2)C(=N1)N
InChIKey
SHBCCEDOUTZFFW-UHFFFAOYSA-N
InChI
InChI=1S/C7H8N4/c1-11-7-5(6(8)10-11)3-2-4-9-7/h2-4H,1H3,(H2,8,10)

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Work with 1-Methyl-1H-pyrazolo[3,4-B]pyridin-3-ylamine

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-methylpyridine1603-40-340 % similar 2,3-Diaminopyridine452-58-438 % similar 1-(2-Aminopyridin-3-yl)ethan-1-one65326-33-238 % similar 2-Amino-3-bromopyridine13534-99-137 % similar 5,6-Diamino-1,10-phenanthroline168646-54-637 % similar 3-Iodopyridin-2-amine104830-06-036 % similar 2-Amino-3-hydroxypyridine16867-03-136 % similar 2-Amino-3-fluoropyridine21717-95-336 % similar

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

Elsewhere

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