Cas no 923565-71-3 (Benzonitrile, 3-(4-piperidinylamino)-)
923565-71-3 structure
Product Name:Benzonitrile, 3-(4-piperidinylamino)-
CAS No:923565-71-3
MF:C12H15N3
MW:201.267602205276
CID:737253
PubChem ID:25223797
Update Time:2025-04-19
Benzonitrile, 3-(4-piperidinylamino)- Chemical and Physical Properties
Names and Identifiers
-
- Benzonitrile, 3-(4-piperidinylamino)-
- 3-(piperidin-4-ylamino)benzonitrile
- DTXSID40649376
- 3-[(Piperidin-4-yl)amino]benzonitrile
- KSRWSIZHVGHDIS-UHFFFAOYSA-N
- AKOS010243432
- 923565-71-3
- SCHEMBL377499
- 3-(4-Piperidinylamino)benzonitrile
-
- Inchi： 1S/C12H15N3/c13-9-10-2-1-3-12(8-10)15-11-4-6-14-7-5-11/h1-3,8,11,14-15H,4-7H2
- InChI Key： KSRWSIZHVGHDIS-UHFFFAOYSA-N
- SMILES： N1CCC(CC1)NC1C=CC=C(C#N)C=1
Computed Properties
- Exact Mass: 201.126597491g/mol
- Monoisotopic Mass: 201.126597491g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 237
- 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: 1.7
- Topological Polar Surface Area: 47.8?2
Benzonitrile, 3-(4-piperidinylamino)- Related Literature
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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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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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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