1H-Pyrazolo[3,4-B]pyridin-3-amine

C6H6N4CAS 6752-16-5134.14 g/mol

Open in Covalent MOL file
NHNNNH2
Primary amine

Properties

Molecular formula
C6H6N4
Molar mass
134.14 g/mol
Exact mass
134.0592 Da
logP
0.54Crippen estimate
Polar surface area
67.6 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
0

Hazards

Danger
Acute Toxic (GHS06)

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P301+P316, P321, P330, P405, P501

Identifiers

CAS number
6752-16-5
SMILES
C1=CC2=C(NN=C2N=C1)N
InChIKey
LUAQTQAFUORQHV-UHFFFAOYSA-N
InChI
InChI=1S/C6H6N4/c7-5-4-2-1-3-8-6(4)10-9-5/h1-3H,(H3,7,8,9,10)

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Work with 1H-Pyrazolo[3,4-B]pyridin-3-amine

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

1H-Pyrazolo[3,4-B]pyridine,3-methyl-(9ci)116834-96-956 % similar 3-Iodo-1H-pyrazolo(3,4-b)pyridine117007-52-056 % similar 3-Bromo-1H-pyrazolo(3,4-b)pyridine68618-36-056 % similar 1H-Pyrazolo[3,4-B]pyridine-3-carbonitrile956010-88-151 % similar 1H-Pyrazolo[3,4-B]pyridine-3-carboxylicacid(9ci)116855-08-447 % similar 5-Bromo-1H-pyrazolo[3,4-b]pyridin-3-amine405224-24-047 % similar 5,6-Diamino-1,10-phenanthroline168646-54-641 % similar 1H-1,2,3-Triazolo(4,5-b)pyridine273-34-739 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Pyrazolo[1,5-a]pyrimidin-2-amine1159982-76-9 7-Deazaadenine1500-85-2 Pyrrolo[2,1-f][1,2,4]triazin-4-amine159326-68-8 1-Aminobenzotriazole1614-12-6 5H-Pyrrolo[3,2-D]pyrimidin-4-amine (9ci)2227-98-7 2,2'-Biimidazole492-98-8 4-Amino-2-methyl-5-pyrimidinecarbonitrile698-29-3

Elsewhere

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