Cas no 64995-64-8 (1H-Imidazole-5-carboxamide, 1-methyl-4-(methylamino)-)
64995-64-8 structure
Product Name:1H-Imidazole-5-carboxamide, 1-methyl-4-(methylamino)-
CAS No:64995-64-8
MF:C6H10N4O
MW:154.169800281525
CID:409527
PubChem ID:13521432
Update Time:2025-04-19
1H-Imidazole-5-carboxamide, 1-methyl-4-(methylamino)- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Imidazole-5-carboxamide, 1-methyl-4-(methylamino)-
- 3-methyl-5-(methylamino)imidazole-4-carboxamide
- SCHEMBL18256648
- 64995-64-8
- 1-Methyl-4-(methylamino)-1H-imidazole-5-carboxamide
- DTXSID40542853
-
- Inchi： 1S/C6H10N4O/c1-8-6-4(5(7)11)10(2)3-9-6/h3,8H,1-2H3,(H2,7,11)
- InChI Key： YGOLKCOFYCUKPM-UHFFFAOYSA-N
- SMILES： O=C(C1=C(N=CN1C)NC)N
Computed Properties
- Exact Mass: 154.0856
- Monoisotopic Mass: 154.08546096g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 161
- 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: 0.1
- Topological Polar Surface Area: 72.9?2
Experimental Properties
- PSA: 72.94
1H-Imidazole-5-carboxamide, 1-methyl-4-(methylamino)- Related Literature
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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