3-Amino-N-methylpiperidine dihydrochloride

C₆H₁₆Cl₂N₂CAS 894808-73-2187.11 g/mol

Open in Covalent MOL file

Primary amine Tertiary amine

Properties

Molecular formula: C₆H₁₆Cl₂N₂
Molar mass: 187.11 g/mol
Exact mass: 186.0691 Da
logP: 0.88Crippen estimate
Polar surface area: 29.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowed50% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled50% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 2 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, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

894808-73-2

SMILES

CN1CCCC(N)C1.Cl.Cl

InChIKey

LUOGVMPUQUBQTC-UHFFFAOYSA-N

InChI

InChI=1S/C6H14N2.2ClH/c1-8-4-2-3-6(7)5-8;;/h6H,2-5,7H2,1H3;2*1H

Weigh it out

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

Names and synonyms

5 names

3-Piperidinamine, 1-methyl-, hydrochloride (1:2)
3-Piperidinamine, 1-methyl-, dihydrochloride
(1-Methylpiperidin-3-yl)amine dihydrochloride
3-Amino-1-methylpiperidine dihydrochloride
1-Methylpiperidin-3-amine dihydrochloride

Work with 3-Amino-N-methylpiperidine 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

Similar compounds

(1-Methylpiperidin-3-yl)methanamine14613-37-747 % similar 4-Amino-1-methylpiperidine41838-46-446 % similar Cyclobutylammonium chloride6291-01-646 % similar 1-Methylpiperidine-3-carboxylic acid hydrochloride19999-64-546 % similar 3-Hydroxy-1-methylpiperidine3554-74-345 % similar Cyclohexylamine hydrochloride4998-76-944 % similar (3S)-1-(Phenylmethyl)-3-piperidinamine dihydrochloride307532-02-144 % similar 1-Methyl-3-piperidinemethanol7583-53-142 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Amino-1-methylpiperidine dihydrochloride1193-03-9 N-Methylpiperidin-4-amine dihydrochloride1220039-56-4 3-(Methylamino)piperidine dihydrochloride127294-77-3 (S)-3-Dimethylaminopyrrolidine 2hcl144043-20-9

Elsewhere

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