chempirical

Pyrrolo[2,1-f][1,2,4]triazin-4-amine

C6H6N4CAS 159326-68-8134.14 g/mol

Open in Covalent MOL file
NNNNH2
Primary amine

Properties

Molecular formula
C6H6N4
Molar mass
134.14 g/mol
Exact mass
134.0592 Da
logP
0.31Crippen estimate
Polar surface area
56.2 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
159326-68-8
SMILES
C1=CN2C(=C1)C(=NC=N2)N
InChIKey
VSPXQZSDPSOPRO-UHFFFAOYSA-N
InChI
InChI=1S/C6H6N4/c7-6-5-2-1-3-10(5)9-4-8-6/h1-4H,(H2,7,8,9)

Weigh it out

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

Names and synonyms

1 names
  • Pyrrolo[1,2-F][1,2,4]triazin-4-amine

Work with Pyrrolo[2,1-f][1,2,4]triazin-4-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

4-Chloropyrrolo[1,2-F][1,2,4]triazine888720-29-456 % similar 7-Iodopyrrolo[2,1-f][1,2,4]triazin-4-amine1770840-43-144 % similar 7-Bromopyrrolo[2,1-f][1,2,4]triazin-4-amine937046-98-544 % similar 8-Bromo-[1,2,4]triazolo[1,5-A]pyridine868362-18-944 % similar 3-Bromo-pyrazolo[1,5-A]pyridine5910-12-336 % similar 4-Amino-7-bromoimidazo[2,1-F][1,2,4]triazine1235374-44-333 % similar 4-Amino-1-phenylpyrazolo(3,4-d)pyrimidine5334-30-533 % similar 7-Bromo-(1,2,4)triazolo(1,5-a)pyridine1053655-66-532 % similar

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

Same formula

7-Deazaadenine1500-85-2 1-Aminobenzotriazole1614-12-6 5H-Pyrrolo[3,2-D]pyrimidin-4-amine (9ci)2227-98-7 2,2′-Biimidazole492-98-8 1H-Pyrazolo[3,4-B]pyridin-3-amine6752-16-5 4-Amino-2-methyl-5-pyrimidinecarbonitrile698-29-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook