Cas no 89994-82-1 (1H-Imidazole-4-carboxamide,5-amino-2-cyano-)
89994-82-1 structure
Product Name:1H-Imidazole-4-carboxamide,5-amino-2-cyano-
CAS No:89994-82-1
MF:C5H5N5O
MW:151.126099348068
CID:712704
PubChem ID:45084305
Update Time:2025-04-19
1H-Imidazole-4-carboxamide,5-amino-2-cyano- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Imidazole-4-carboxamide,5-amino-2-cyano-
- 1H-Imidazole-4-carboxamide,5-amino-2-cyano-(9CI)
- 4-amino-2-cyano-1H-imidazole-5-carboxamide
- 89994-82-1
- DTXSID70665584
-
- Inchi： 1S/C5H5N5O/c6-1-2-9-3(5(8)11)4(7)10-2/h7H2,(H2,8,11)(H,9,10)
- InChI Key： BSCKEDSDTYBDCW-UHFFFAOYSA-N
- SMILES： O=C(C1=C(N)N=C(C#N)N1)N
Computed Properties
- Exact Mass: 151.049
- Monoisotopic Mass: 151.049
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 218
- 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: 122A^2
- XLogP3: -0.5
1H-Imidazole-4-carboxamide,5-amino-2-cyano- Related Literature
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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