Alpha-Ethyltryptamine

HCID 8367

기본 정보

CAS
2235-90-7
표준 SMILES
CCC(N)Cc1c[nH]c2ccccc12
InChIKey
ZXUMUPVQYAFTLF-UHFFFAOYSA-N
분자식
C12H16N2
평균 분자량
188.27 g/mol
단동위원소 질량
188.13134852

이름 및 식별자

우선 이름
Alpha-Ethyltryptamine
IUPAC
1-(1H-indol-3-yl)butan-2-amine
영어명
α-Ethyltryptamine
분자식
C12H16N2
분자량
188.27

이름 및 동의어

ETRYPTAMINEalpha-Ethyltryptamine3-(2-Aminobutyl)indole2235-90-73-IndolylbutylamineEtriptaminaMonaseRo 3-1932Etryptaminum1H-Indole-3-ethanamine, alpha-ethyl-alphaETDTXSID1046764
이름 더 보기
AURORA KA-7710Ethyltryptamineα-EthyltryptamineA-ETHYLTRYPTAMINE HCL
NSC-88061GR181O3R32DTXCID9026764NSC880612-ethyltryptamine3-(2-aminobutylindole)RefChem:1393041-(1H-indol-3-yl)butan-2-amine

데이터베이스 식별자

CAS
2235-90-7
PubChem CID
8367
DTXSID
DTXSID1046764
ChEMBL
CHEMBL1619758
ChEBI
CHEBI:134838
UNII
GR181O3R32
Nikkaji
J7.373C

물성

구조 계산 물성

XLogP
2.5
극성 표면적
41.8 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
1
회전 가능 결합 수
3
무거운 원자 수
14

실험 및 물리화학적 성질

LogS-2.57
Solubility510
Melting Point221
Kovats Retention Index1848

물리화학적 성질

녹는점
97 · 97-99°
끓는 점
313.29 °C · 313.29°C (rough estimate)
밀도
0.952 · 0.9520 (rough estimate)
굴절률
1.56 · 1.5600 (estimate)
용해도
11 mg/ml; · DMF: 11 mg/ml; DMSO: 5 mg/ml; Ethanol: 20 mg/ml; Ethanol:PBS(pH 7.2) (1:1): 0.5 mg/ml
물리적 상태
결정성 고체

안전 및 규제

유해성 정보

Regulatory InformationDEA schedule I controlled substance

규제 정보

Regulatory InformationDEA schedule I controlled substance

화학 및 산업

약리 정보

PharmacodynamicsαET is a stimulant and psychedelic with MDMA like physiological effects. Like MDMA, increases in locomotor activity and mood elevation can be seen post administration. [2]
Mechanism of Action · 1건

The mechanism of action responsible for its antidepressant activity was believed to lie in its ability to inhibit monoamine oxidase, while its stimulant activity on the central nervous system appeared to result from its structural similarity to indole-based psychedelics. [5] Research discovered αET to be both a monoamine oxidase inhibitor and a potent monoamine releasing agent capable of serotonergic neurotoxicity. [3] The ability to release serotonin was linked to αET's MDMA like properties. [2] αET has been shown to release serotonin pre-synaptically, as well as lesser amounts of norepinephrine and dopamine.

응용 분야

용도α-Ethyltryptamine (E931900) is used as a stimulant and entactogen that have actions at multiple central nervous system (CNS) receptor sites.

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4건

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