5-MeO-DALT
5-Methoxy-N,N-diallyltryptamine is a substituted tryptamine compound featuring a methoxy group on the indole ring and two allyl groups attached to the terminal nitrogen. It is commonly abbreviated as 5-MeO-DALT and is documented in established chemical databases and crystallographic literature.
About the Compound
5-MeO-DALT
belongs to the tryptamine chemical family. Its structure incorporates a 5-methoxy-substituted indole ring together with an N,N-diallyl aminoethyl side chain.
PubChem identifies the compound as CID 50878551 and records the molecular formula as C17H22N2O. The reported molecular weight is 270.37 g/mol and the CAS Registry Number is 928822-98-4. :chatgpt-content-reference{index=”1″}
The material has also been independently characterized through single-crystal X-ray diffraction. A 2020 IUCrData publication reports the freebase crystal structure and confirms the molecular composition and structural arrangement. :chatgpt-content-reference{index=”2″}
Chemical Specifications
Molecular Structure
The systematic chemical name is
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-prop-2-enylprop-2-en-1-amine.
The structure contains an indole core, a methoxy substituent at the 5-position and two allyl substituents attached to the terminal nitrogen.
IUPAC Name
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-prop-2-enylprop-2-en-1-amine
Molecular Formula
C17H22N2O
SMILES
COC1=CC2=C(C=C1)NC=C2CCN(CC=C)CC=C
InChIKey
HGRHWEAUHXYNNP-UHFFFAOYSA-N
Research & Analytical Context
The compound has been examined through chemical and structural research, including crystallographic analysis. The published IUCrData study reports a single molecule in the asymmetric unit and describes the crystal packing and hydrogen-bonding arrangement observed in the freebase material. :chatgpt-content-reference{index=”3″}
The reported crystal structure belongs to the monoclinic P21/n space group. Experimental crystallographic measurements gave a molecular mass of 270.36 and a unit-cell volume of approximately 1525.9 ų. :chatgpt-content-reference{index=”4″}
For analytical documentation, the molecular formula, CAS number, exact mass, systematic nomenclature, SMILES representation and InChIKey provide complementary methods for identifying the material.
Chemical Identification
The documented identity corresponds to 5-methoxy-N,N-diallyltryptamine. PubChem lists CAS 928822-98-4, CID 50878551 and the InChIKey HGRHWEAUHXYNNP-UHFFFAOYSA-N. :chatgpt-content-reference{index=”5″}
The calculated molecular weight is 270.37 g/mol, while PubChem reports an exact mass of 270.173213330 Da. The database also records one hydrogen-bond donor, two hydrogen-bond acceptors and eight rotatable bonds. :chatgpt-content-reference{index=”6″}
It is important to distinguish the freebase from separately documented salt forms. The freebase crystal structure has been directly characterized in the published crystallographic literature, while other salt forms have their own chemical records and molecular compositions.
Product Summary
- Product:
5-MeO-DALT - Alternative Name:
5-Methoxy-N,N-diallyltryptamine - CAS:
928822-98-4 - PubChem CID:
50878551 - Formula:
C17H22N2O - Molecular Weight:
270.37 g/mol - Chemical Family:
Tryptamine
Scientific Reference
For additional chemical identification and molecular information,
PubChem’s 5-MeO-DALT compound record
provides reference information including the molecular formula, molecular weight, CAS number, IUPAC name, SMILES and InChIKey.
The freebase crystal structure is also documented in the
IUCrData crystallographic publication
.
The information on this page is provided for chemical identification and research documentation. Appropriate laboratory procedures, analytical verification and institutional safety protocols should be followed when handling research materials.



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