chempirical

8-Isoquinolinamine

C9H8N2CAS 23687-27-6144.18 g/mol

Open in Covalent MOL file
NH2N
Primary amine

Properties

Molecular formula
C9H8N2
Molar mass
144.18 g/mol
Exact mass
144.0687 Da
Melting point
174 °C
logP
1.82Crippen estimate
Polar surface area
38.9 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0

Identifiers

CAS number
23687-27-6
SMILES
Nc1cccc2ccncc12
InChIKey
GUSYANXQYUJOBH-UHFFFAOYSA-N
InChI
InChI=1S/C9H8N2/c10-9-3-1-2-7-4-5-11-6-8(7)9/h1-6H,10H2

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

Names and synonyms

2 names
  • Isoquinoline, 8-amino-
  • 8-Aminoisoquinoline

Work with 8-Isoquinolinamine

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

1-Naphthylamine134-32-756 % similar α-Naphthylamine hydrochloride552-46-550 % similar Isoquinoline119-65-346 % similar 1,5-Diaminonaphthalene2243-62-146 % similar 4-Chloro-3-pyridinamine20511-15-345 % similar Anthramine610-49-145 % similar 8-Amino-2-naphthol118-46-744 % similar 1,8-Diaminonaphthalene479-27-643 % similar

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

Same formula

5-Aminoisoquinoline1125-60-6 1-Phenylpyrazole1126-00-7 7-Indolinecarbonitrile115661-82-0 5-Methylquinoxaline13708-12-8 1-Isoquinolinamine1532-84-9 4-Isoquinolinamine23687-25-4 3-Phenylpyrazole2458-26-6 8-Aminoquinoline578-66-5

Elsewhere

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