Cas no 891854-16-3 (Benzonitrile,3-(4-amino-1-piperidinyl)-)
891854-16-3 structure
Product Name:Benzonitrile,3-(4-amino-1-piperidinyl)-
CAS No:891854-16-3
MF:C12H15N3
MW:201.267602205276
CID:714474
PubChem ID:45116760
Update Time:2025-04-19
Benzonitrile,3-(4-amino-1-piperidinyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzonitrile,3-(4-amino-1-piperidinyl)-
- Benzonitrile, 3-(4-amino-1-piperidinyl)- (9CI)
- 891854-16-3
- 3-(4-Amino-1-piperidinyl)benzonitrile
- IOTATSXBYFMYCH-UHFFFAOYSA-N
- AKOS010946408
- 3-(4-aminopiperidin-1-yl)-benzonitrile
- SCHEMBL3051168
-
- Inchi： 1S/C12H15N3/c13-9-10-2-1-3-12(8-10)15-6-4-11(14)5-7-15/h1-3,8,11H,4-7,14H2
- InChI Key： IOTATSXBYFMYCH-UHFFFAOYSA-N
- SMILES： N1(C2C=CC=C(C#N)C=2)CCC(CC1)N
Computed Properties
- Exact Mass: 201.127
- Monoisotopic Mass: 201.127
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 247
- 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: 53A^2
- XLogP3: 1.4
Benzonitrile,3-(4-amino-1-piperidinyl)- Related Literature
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
891854-16-3 (Benzonitrile,3-(4-amino-1-piperidinyl)-) Related Products
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- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
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