(R)-(-)-3-Aminopiperidine dihydrochloride

C₅H₁₄Cl₂N₂CAS 334618-23-4173.08 g/mol

Open in Covalent MOL file

Primary amine Secondary amine

Properties

Molecular formula: C₅H₁₄Cl₂N₂
Molar mass: 173.08 g/mol
Exact mass: 172.0534 Da
logP: 0.54Crippen estimate
Polar surface area: 38.0 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 0
Stereocentres: Rin SMILES atom order

Hazards

Danger

H302 Harmful if swallowed88% of notifiers
H315 Causes skin irritation100% of notifiers
H318 Causes serious eye damage88% of notifiers
H319 Causes serious eye irritation16% of notifiers
H335 May cause respiratory irritation98% of notifiers

Aggregated from 50 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

334618-23-4

SMILES

Cl.Cl.N[C@@H]1CCCNC1

InChIKey

GGPNYXIOFZLNKW-ZJIMSODOSA-N

InChI

InChI=1S/C5H12N2.2ClH/c6-5-2-1-3-7-4-5;;/h5,7H,1-4,6H2;2*1H/t5-;;/m1../s1

Weigh it out

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

Names and synonyms

4 names

3-Piperidinamine, hydrochloride (1:2), (3R)-
3-Piperidinamine, dihydrochloride, (3R)-
(R)-3-Aminopiperidine dihydrochloride
(R)-Piperidin-3-amine dihydrochloride

Work with (R)-(-)-3-Aminopiperidine dihydrochloride

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

3-Aminopiperidine54012-73-6Free base, stereo not defined (3R)-Piperidin-3-amine127294-73-9Free base (S)-Piperidin-3-amine80918-66-7Free base, enantiomer (S)-3-Aminopiperidine dihydrochloride334618-07-4Enantiomer Piperidin-3-amine dihydrochloride138060-07-8Stereo not defined

Similar compounds

3-Aminopyrrolidine dihydrochloride103831-11-474 % similar (R)-3-Aminopyrrolidine dihydrochloride116183-81-474 % similar (S)-3-Aminopyrrolidine dihydrochloride116183-83-674 % similar (+/-)-3-Amino-homopiperidine69154-03-674 % similar (R)-3-Aminopyrrolidine116183-82-561 % similar (-)-3-Aminopyrrolidine128345-57-361 % similar 3-Aminopyrrolidine79286-79-661 % similar Cyclobutylammonium chloride6291-01-652 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-(Dimethylamino)azetidine dihydrochloride124668-49-1 1-Methylpiperazine dihydrochloride34352-59-5 4-Aminopiperidine dihydrochloride35621-01-3

Elsewhere

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