Cas no 646523-34-4 (2-Piperazinecarboxamide,N-propyl-)
646523-34-4 structure
Product Name:2-Piperazinecarboxamide,N-propyl-
CAS No:646523-34-4
MF:C8H17N3O
MW:171.240081548691
CID:500267
PubChem ID:11229047
Update Time:2025-04-19
2-Piperazinecarboxamide,N-propyl- Chemical and Physical Properties
Names and Identifiers
-
- 2-Piperazinecarboxamide,N-propyl-
- 2-Piperazinecarboxamide,N-propyl-(9CI)
- N-PROPYLPIPERAZINE-2-CARBOXAMIDE
- 2-Piperazinecarboxamide,N-propyl
- piperazine-2-carboxylic acid propylamide
- SCHEMBL6626467
- AKOS012402823
- 646523-34-4
- DTXSID20459374
-
- Inchi： 1S/C8H17N3O/c1-2-3-11-8(12)7-6-9-4-5-10-7/h7,9-10H,2-6H2,1H3,(H,11,12)
- InChI Key： SUJXBNUVGOWGRO-UHFFFAOYSA-N
- SMILES： O=C(C1CNCCN1)NCCC
Computed Properties
- Exact Mass: 171.13700
- Monoisotopic Mass: 171.137162174g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 149
- 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: -0.2
- Topological Polar Surface Area: 53.2?2
Experimental Properties
- PSA: 53.16000
- LogP: 0.12250
2-Piperazinecarboxamide,N-propyl- Related Literature
-
Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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