Cas no 121665-18-7 (1-Piperazineacetamide,4-(1-methylethyl)-)
121665-18-7 structure
Product Name:1-Piperazineacetamide,4-(1-methylethyl)-
CAS No:121665-18-7
MF:C9H19N3O
MW:185.266661882401
CID:104669
PubChem ID:45115637
Update Time:2025-04-18
1-Piperazineacetamide,4-(1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1-Piperazineacetamide,4-(1-methylethyl)-
- 2-[4-(1-METHYLETHYL)PIPERAZIN-1-YL]ACETAMIDE
- 1-Piperazineacetamide,4-(1-methylethyl)-(9CI)
- 2-(4-propan-2-ylpiperazin-1-yl)acetamide
- 2-[4-(Propan-2-yl)piperazin-1-yl]acetamide
- DTXSID50668270
- AKOS009116534
- SCHEMBL2129390
- 121665-18-7
-
- Inchi： 1S/C9H19N3O/c1-8(2)12-5-3-11(4-6-12)7-9(10)13/h8H,3-7H2,1-2H3,(H2,10,13)
- InChI Key： NBQZVHBGRBGPKZ-UHFFFAOYSA-N
- SMILES： O=C(CN1CCN(C(C)C)CC1)N
Computed Properties
- Exact Mass: 185.15297
- Monoisotopic Mass: 185.153
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 174
- 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
- Topological Polar Surface Area: 49.6A^2
- XLogP3: -0.2
Experimental Properties
- PSA: 49.57
1-Piperazineacetamide,4-(1-methylethyl)- Related Literature
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
-
Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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