N-(2-(1H-Indol-3-yl)ethyl)acetamide N-(2-(1H-吲哚-3-基)乙基)乙酰胺
CAS 1016-47-3 MFCD00209910
化学结构图
SMILES: CC(=O)NCCc1c[nH]c2ccccc12
化学属性
| Mol. Formula | C12H14N2O |
|---|---|
| Mol. Weight | 202.25 |
| Boiling Point | 200 °C at 0.2 mmHg |
| Melting Point | 74.0-78.0 °C |
别名和识别编码
| Chemical Name | N-(2-(1H-Indol-3-yl)ethyl)acetamide |
|---|---|
| Synonym | N-Acetyltryptamine {LY} N-Acetyltryptamine {} {LY} N-Acetyltryptamine {} {} {LY} N-Acetyltryptamine {} {} {} {LY} N-Acetyltryptamine {} {} {} {} {LY} N-Acetyltryptamine {} {} {} {} {} {LY} N-Acetyltryptamine {} {} {} {} {} {} {LY} N-Acetyltryptamine {} {} {} {} {} {} {} {LY} N-Acetyltryptamine {} {} {} {} {} {} {} {} {LY} N-Acetyltryptamine {} {} {} {} {} {} {} {} {} {LY} N-Acetyltryptamine {} {} {} {} {} {} {} {} {} {} {LY} N-Acetyltryptamine {} {} {} {} {} {} {} {} {} {} {} {LY} N-Acetyltryptamine {} {} {} {} {} {} {} {} {} {} {} {} {LY} N-Acetyltryptamine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} N-Acetyltryptamine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} N-Acetyltryptamine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} N-Acetyltryptamine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} |
| CAS Number | 1016-47-3 |
| MDL Number | MFCD00209910 |
| PubChem Substance ID | 70547 |
| Chemical Name Translation | N-(2-(1H-吲哚-3-基)乙基)乙酰胺 |
| Reaxys-RN | 170780 |
| InChIKey | NVUGEQAEQJTCIX-UHFFFAOYSA-N |
| LabNetwork Molecule ID | LN01740172 |
| InChI | InChI=1S/C12H14N2O/c1-9(15)13-7-6-10-8-14-12-5-3-2-4-11(10)12/h2-5,8,14H,6-7H2,1H3,(H,13,15) |
| Canonical SMILES | CC(NCCC1=CNC2=C1C=CC=C2)=O |
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分类
- {uni_hamburg} no charge; nitrogen heterocycle; carbocycle; aromatic; large ring; fused rings; 5ring; 6ring; 9ring; amide; 1fragment
- {SNA} A-AM, Bioactive Small Molecules, Cell Biology, Cell Signaling and Neuroscience, Melatonins, Neurobiology, Neuroscience, Pharmacologicals
相关文献及参考
- Short: III/35C2 Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts and Coupling Constants for Hydrogen-1, Part 2: Heterocycles Author: Gupta, R.R.; Jain, M. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35C2 Year: 2003 Keyword: chemical shift; coupling constant; molecular structure ISBN: 3-540-41057-0 ISBN: 978-3-540-41057-7 Internet Resource: DOI:10.1007/b89252 RefComment: VIII, 310 pages. With CD-ROM. Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), and carbon-13 (subvol. D) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CD-ROM's.
