5-Methyltryptamine hydrochloride

C11H15ClN2CAS 55795-89-6210.70 g/mol

Open in Covalent MOL file
HNNH2HCl
Primary amine

Properties

Molecular formula
C11H15ClN2
Molar mass
210.70 g/mol
Exact mass
210.0924 Da
logP
2.40Crippen estimate
Polar surface area
41.8 Ų
H-bond donors / acceptors
2 / 1
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number
55795-89-6
SMILES
CC1=CC2=C(C=C1)NC=C2CCN.Cl
InChIKey
RBHDFGBPJGEYCK-UHFFFAOYSA-N
InChI
InChI=1S/C11H14N2.ClH/c1-8-2-3-11-10(6-8)9(4-5-12)7-13-11;/h2-3,6-7,13H,4-5,12H2,1H3;1H

Weigh it out

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

Work with 5-Methyltryptamine 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.

5-Methyltryptamine1821-47-2Free base 5-Methyltryptamine hydrochloride1010-95-3

Similar compounds

Mexamine66-83-166 % similar Serotonin hydrochloride153-98-065 % similar 5-Fluorotryptamine hydrochloride2711-58-265 % similar 5-Chlorotryptamine hydrochloride942-26-765 % similar Tryptamine hydrochloride343-94-261 % similar 5-Methoxytryptamine608-07-159 % similar 5-Chlorotryptamine3764-94-157 % similar Serotonin50-67-957 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1-((2-Chlorophenyl)methyl)piperazine17532-19-3 1-(4-Chlorobenzyl)piperazine23145-88-2 1-(3-Chlorobenzyl)piperazine23145-91-7 1-(5-Chloro-2-methylphenyl)piperazine76835-20-6

Elsewhere

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