Cas no 6381-00-6 (4-Pyrimidinamine,2-methyl-N-2-propen-1-yl-)
6381-00-6 structure
Product Name:4-Pyrimidinamine,2-methyl-N-2-propen-1-yl-
CAS No:6381-00-6
MF:C8H11N3
MW:149.193041086197
CID:500692
PubChem ID:45080494
Update Time:2025-04-19
4-Pyrimidinamine,2-methyl-N-2-propen-1-yl- Chemical and Physical Properties
Names and Identifiers
-
- Pyrimidine,4-(allylamino)-2-methyl- (7CI,8CI)
- 4-Pyrimidinamine,2-methyl-N-2-propen-1-yl-
- Pyrimidine, 4-(allylamino)-2-methyl- (7CI,8CI)
- N-Allyl-2-methyl-4-pyrimidinamine
- 2-methyl-N-prop-2-enylpyrimidin-4-amine
- AKOS012078489
- 6381-00-6
-
- Inchi： 1S/C8H11N3/c1-3-5-10-8-4-6-9-7(2)11-8/h3-4,6H,1,5H2,2H3,(H,9,10,11)
- InChI Key： ZVNKKMKGKRQVJT-UHFFFAOYSA-N
- SMILES： N(CC=C)C1C=CN=C(C)N=1
Computed Properties
- Exact Mass: 149.09543
- Monoisotopic Mass: 149.095
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 3
- Complexity: 125
- 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: 37.8A^2
- XLogP3: 1.6
Experimental Properties
- PSA: 37.81
4-Pyrimidinamine,2-methyl-N-2-propen-1-yl- Related Literature
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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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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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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