N,α-Dimethylphenethylamine hydrochloride

C₁₀H₁₆ClNCAS 300-42-5185.70 g/mol

Open in Covalent MOL file

Secondary amine

Properties

Molecular formula: C₁₀H₁₆ClN
Molar mass: 185.70 g/mol
Exact mass: 185.0971 Da
Melting point: 133–135 °C
Water solubility: ≥ 100 g/L (20 °C)
logP: 2.26Crippen estimate
Polar surface area: 12.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 3

Hazards

Danger

H300 Fatal if swallowed100% of notifiers
H311 Toxic in contact with skin97.4% of notifiers
H330 Fatal if inhaled100% of notifiers
H361 Suspected of damaging fertility or the unborn child97.4% of notifiers

Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P260, P262, P264, P270, P271, P280, P284, P301+P316, P302+P352, P304+P340, P316, P318, P320, P321, P330, P361+P364, P403+P233, P405, P501

Identifiers

CAS number

300-42-5

SMILES

CNC(C)Cc1ccccc1.Cl

InChIKey

TWXDDNPPQUTEOV-UHFFFAOYSA-N

InChI

InChI=1S/C10H15N.ClH/c1-9(11-2)8-10-6-4-3-5-7-10;/h3-7,9,11H,8H2,1-2H3;1H

Weigh it out

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

Names and synonyms

13 names · show all

Benzeneethanamine, N,α-dimethyl-, hydrochloride (1:1)
Phenethylamine, N,α-dimethyl-, hydrochloride
Benzeneethanamine, N,α-dimethyl-, hydrochloride
2-Methylamino-1-phenylpropane hydrochloride
Obesin
Obesine
Dl-Desoxyephedrine hydrochloride
Dl-Methamphetamine hydrochloride
(±)-Methamphetamine hydrochloride
(±)-N-Methylamphetamine hydrochloride
NSC 169506
NSC 22367
(±)-Methylamphetamine hydrochloride

Work with N,α-Dimethylphenethylamine hydrochloride

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.

Meth537-46-2Free base, defined stereoisomer

Similar compounds

o-Methoxy-N,α-dimethylphenethylamine hydrochloride5588-10-355 % similar 1,2-Diphenylethyl-N-methylamine53663-25-552 % similar Isobutylbenzene538-93-247 % similar MDMA42542-10-946 % similar (R,R)-1,6-Diphenylhexane-2,5-diamine dihydrochloride1247119-31-844 % similar 4-Methoxy-alpha-methyl-N-(phenylmethyl)benzeneethanamine43229-65-844 % similar 4-Bromo-N-isopropylamphetamine hydrochloride109971-39-344 % similar 1-Benzyl-N,4-dimethyl-piperidin-3-amine dihydrochloride, (3R,4R)-1062580-52-243 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

N,N-Dimethylphenethylamine hydrochloride10275-21-5 N-Butyl-4-methylpyridinium chloride112400-86-9 Phentermine hydrochloride1197-21-3 3-Methyl-N-butylpyridinium chloride125652-55-3 Benzyltrimethylammonium chloride56-93-9

Elsewhere

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