5-Methyltryptamine , CAS No.1821-47-2

CAS: 1821-47-2 Cat. No.: M667851 Fórmula: C11H14N2 Peso molecular: 174.24 PubChem CID: 15760
Disponible para pedir
Synonyms
5-Methyltryptamine|2-(5-methyl-1H-indol-3-yl)ethanamine|5-methyl-1H-Indole-3-ethanamine|5-Methyl-3-(aminoethyl)indole|1H-Indole-3-ethanamine, 5-methyl-|2-(5-methyl-1H-indol-3-yl)ethan-1-amine|INDOLE, 3-(AMINOETHYL)-5-METHYL-|1H-Indole-3-ethanamine, 5-methyl|2-(5-Methyl-1H-indol-3-yl)-ethylamine|2-(5-methyl-1~{H}-indol-3-yl)ethanamine|5-metyltryptamine|1H-Indole-3-ethanamine,5-methyl-|Tryptamine, 5-methyl|5-Methyl-tryptamine, 10|SDCCGMLS-0065817.P001|2-(5-Methyl-1H-indol-3-yl)ethylamine #|CVW
Storage
Room temperature
★
Talla
Alemania (EU)
USA*
Precio
Cantidad
1mg
M667851-1mg
Fabricado bajo pedido · 8–12 semanas

496,26€

744,43€
Guardar 248,17 € (33.34%)
5mg
M667851-5mg
Fabricado bajo pedido · 8–12 semanas

1.735,39€

2.603,13€
Guardar 867,74 € (33.33%)
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Especificaciones

Sinónimos
5-Methyltryptamine | 2-(5-methyl-1H-indol-3-yl)ethanamine | 5-methyl-1H-Indole-3-ethanamine | 5-Methyl-3-(aminoethyl)indole | 1H-Indole-3-ethanamine, 5-methyl- | 2-(5-methyl-1H-indol-3-yl)ethan-1-amine | INDOLE, 3-(AMINOETHYL)-5-METHYL- | 1H-Indole-3-ethanamine, 5-methyl | 2-(5-Methyl-1H-indol-3-yl)-ethylamine | 2-(5-methyl-1~{H}-indol-3- Show more
Condiciones de almacenamiento de almacenamiento
Room temperature
Propiedades del producto
ALogP
1.9
Nombres e identificadores
Sonrisas canónicas
CC1=CC2=C(C=C1)NC=C2CCN
IUPAC Name
2-(5-methyl-1H-indol-3-yl)ethanamine
InChIKey
PYOUAIQXJALPKW-UHFFFAOYSA-N
INCHI
1S/C11H14N2/c1-8-2-3-11-10(6-8)9(4-5-12)7-13-11/h2-3,6-7,13H,4-5,12H2,1H3
Isómeros SMILES
CC1=CC2=C(C=C1)NC=C2CCN
PubChem CID
15760
Peso molecular
174.24

Datos avanzados

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClaseIndoles and derivatives
SubclassTryptamines and derivatives
Intermediate Tree Nodes Not available
Direct ParentTryptamines and derivatives
Alternative Parents 3-alkylindoles  2-arylethylamines  Aralkylamines  Substituted pyrroles  Benzenoids  Heteroaromatic compounds  Azacyclic compounds  Organopnictogen compounds  Monoalkylamines  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Tryptamine - 3-alkylindole - Indole - 2-arylethylamine - Aralkylamine - Substituted pyrrole - Benzenoid - Pyrrole - Heteroaromatic compound - Azacycle - Hydrocarbon derivative - Organopnictogen compound - Amine - Primary amine - Organonitrogen compound - Primary aliphatic amine - Organic nitrogen compound - Aromatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as tryptamines and derivatives. These are compounds containing the tryptamine backbone, which is structurally characterized by an indole ring substituted at the 3-position by an ethanamine.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
HTR2A Tclin 5-hydroxytryptamine receptor 2A (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
HTR1D Tclin 5-hydroxytryptamine receptor 1D (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
SLC6A2 Tclin Norepinephrine transporter (10102 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HTR1D Tclin Serotonin 1d (5-HT1d) receptor (2897 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HTR2A Tclin Serotonin 2a (5-HT2a) receptor (14758 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SLC6A4 Tclin Serotonin transporter (12625 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SLC6A3 Tclin Dopamine transporter (10535 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Objetivos asociados (no humanos)
Pseudomonas aeruginosa (123386 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propiedades químicas y físicas
Peso molecular174.240 g/mol
XLogP31.900
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass174.116 Da
Monoisotopic Mass174.116 Da
Topological Polar Surface Area41.800 Ų
Heavy Atom Count13
Formal Charge0
Complexity169.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Calculadoras de soluciones
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