Cas no 79087-58-4 (Acetamide,N-[2-(5-chloro-1H-indol-3-yl)ethyl]-)
![Acetamide,N-[2-(5-chloro-1H-indol-3-yl)ethyl]- structure](https://ossimg.kuujia.com/scimg/79500/79087-58-4x500.png)
79087-58-4 structure
Product Name:Acetamide,N-[2-(5-chloro-1H-indol-3-yl)ethyl]-
CAS No:79087-58-4
MF:C12H13ClN2O
MW:236.697421789169
CID:554223
PubChem ID:384240
Update Time:2025-04-19
Acetamide,N-[2-(5-chloro-1H-indol-3-yl)ethyl]- Chemical and Physical Properties
Names and Identifiers
-
- Acetamide,N-[2-(5-chloro-1H-indol-3-yl)ethyl]-
- NSC 673655
- N-ACETHYL-5-CHLOROTRYPTAMINE
- N-Acetyl-5-Chloro-Tryptamine
- 79087-58-4
- N-(2-(5-Chloro-1H-indol-3-yl)ethyl)acetamide
- SCHEMBL4510886
- N-[2-(5-Chloro-1H-indol-3-yl)-ethyl]-acetamide
- N-[2-(5-chloro-1H-indol-3-yl)ethyl]acetamide
- AKOS003603581
- NSC673655
- CHEMBL288562
- WJIFPSFOSMKSAB-UHFFFAOYSA-N
- BDBM50471831
- NCI60_026102
- NSC-673655
- {N-[2-(5-Chloro-1H-indol-3-yl)ethyl]acetamide}
-
- Inchi： 1S/C12H13ClN2O/c1-8(16)14-5-4-9-7-15-12-3-2-10(13)6-11(9)12/h2-3,6-7,15H,4-5H2,1H3,(H,14,16)
- InChI Key： WJIFPSFOSMKSAB-UHFFFAOYSA-N
- SMILES： ClC1C=CC2=C(C=1)C(=CN2)CCNC(C)=O
Computed Properties
- Exact Mass: 236.072
- Monoisotopic Mass: 236.072
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 259
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.4
- Topological Polar Surface Area: 44.9?2
Acetamide,N-[2-(5-chloro-1H-indol-3-yl)ethyl]- Related Literature
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Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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