Cas no 137937-98-5 (Acetamide, 2-[[2-(acetylamino)propyl]amino]-N-methyl-)
![Acetamide, 2-[[2-(acetylamino)propyl]amino]-N-methyl- structure](https://ossimg.kuujia.com/scimg/138000/137937-98-5x500.png)
137937-98-5 structure
Product Name:Acetamide, 2-[[2-(acetylamino)propyl]amino]-N-methyl-
CAS No:137937-98-5
MF:C8H17N3O2
MW:187.239481687546
CID:1022096
PubChem ID:45119195
Update Time:2025-04-20
Acetamide, 2-[[2-(acetylamino)propyl]amino]-N-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Acetamide, 2-[[2-(acetylamino)propyl]amino]-N-methyl-
- ACETAMIDE,2-[[2-(ACETYLAMINO)PROPYL]AMINO]-N-METHYL-
- 137937-98-5
- N~2~-(2-Acetamidopropyl)-N-methylglycinamide
-
- Inchi： 1S/C8H17N3O2/c1-6(11-7(2)12)4-10-5-8(13)9-3/h6,10H,4-5H2,1-3H3,(H,9,13)(H,11,12)
- InChI Key： PHVIQRQQDJCZQK-UHFFFAOYSA-N
- SMILES： O=C(C)NC(C)CNCC(NC)=O
Computed Properties
- Exact Mass: 187.13221
- Monoisotopic Mass: 187.132076794g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 5
- Complexity: 182
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -1.1
- Topological Polar Surface Area: 70.2?2
Experimental Properties
- PSA: 70.23
Acetamide, 2-[[2-(acetylamino)propyl]amino]-N-methyl- Related Literature
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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