1,2,3,6-Tetrahydropyridine
Properties
- Molecular formula
- C5H9N
- Molar mass
- 83.13 g/mol
- Exact mass
- 83.0735 Da
- Density
- 0.9153 g/mL (at 20 °C)
- Melting point
- −48 °C
- Boiling point
- 108 °C
- logP
- 0.54Crippen estimate
- Polar surface area
- 12.0 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 0
Identifiers
CAS number
694-05-3SMILES
C1=CCNCC1InChIKey
FTAHXMZRJCZXDL-UHFFFAOYSA-NInChI
InChI=1S/C5H9N/c1-2-4-6-5-3-1/h1-2,6H,3-5H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
5 names
- Pyridine, 1,2,3,6-tetrahydro-
- 1,2,5,6-Tetrahydropyridine
- δ3-Piperidine
- NSC 65443
- 3,6-Dihydro-2H-pyridine
Work with 1,2,3,6-Tetrahydropyridine
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
3-Pyrroline109-96-653 % similar
1,5-Cyclooctadiene111-78-433 % similar
1,5-Cyclooctadiene1552-12-133 % similar
1,5,9-Cyclododecatriene4904-61-433 % similar
Trans,trans,trans-1,5,9-cyclododecatriene676-22-233 % similar
Cyclododecatriene706-31-033 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds