Betahistine
Properties
- Molecular formula
- C8H12N2
- Molar mass
- 136.20 g/mol
- Exact mass
- 136.1000 Da
- Density
- 0.98 g/mL
- Boiling point
- 113–114 °C
- logP
- 0.84Crippen estimate
- Polar surface area
- 24.9 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 3
Identifiers
CAS number
5638-76-6SMILES
CNCCc1ccccn1InChIKey
UUQMNUMQCIQDMZ-UHFFFAOYSA-NInChI
InChI=1S/C8H12N2/c1-9-7-5-8-4-2-3-6-10-8/h2-4,6,9H,5,7H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
18 names · show all
- 2-Pyridineethanamine, N-methyl-
- Pyridine, 2-[2-(methylamino)ethyl]-
- N-Methyl-2-pyridineethanamine
- N-Methyl-2-pyridineethylamine
- [2-(2-Pyridyl)ethyl]methylamine
- β-Histine
- 2-(β-Methylaminoethyl)pyridine
- N-Methyl-2-(2-pyridinyl)ethanamine
- 2-(2-Methylaminoethyl)pyridine
- Methyl(2-pyridin-2-ylethyl)amine
- N-Methyl-N-[2-(2-pyridinyl)ethyl]amine
- N-Methyl-2-(2-pyridyl)ethylamine
- NSC 42617
- Y-G 14
- N-Methyl-N-[2-(pyridin-2-yl)ethyl]amine
- OBE 101
- N-Methyl[2-(pyridin-2-yl)ethyl]amine
- N-[2-(2-Pyridyl)ethyl]-N-methylamine
Work with Betahistine
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
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
Betahistine dihydrochloride5579-84-089 % similar
Betahistine mesylate54856-23-469 % similar
2-Propylpyridine622-39-957 % similar
2-Butylpyridine5058-19-553 % similar
N-Methylphenethylamine589-08-252 % similar
2-Pyridineethanol103-74-252 % similar
2-(3-Phenylpropyl)pyridine2110-18-152 % similar
2-Pyridylethylamine2706-56-152 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds