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2D Structure
Also known as: 1185167-55-8, [(2-isopropyl-1,3-thiazol-4-yl)methyl]methylamine 2hcl, N-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)methanamine;dihydrochloride, 1-(2-isopropyl-1,3-thiazol-4-yl)-n-methylmethanamine dihydrochloride, 2-isopropyl-4-(methylaminomethyl)thiazole dihydrochloride, 2-isopropyl-4(((n-methyl) amino)methyl)thiazole 2hcl
Molecular Formula
C8H16Cl2N2S
Molecular Weight
243.20  g/mol
InChI Key
GNPOLJYMEXUGCG-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
N-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)methanamine;dihydrochloride
2.1.2 InChI
InChI=1S/C8H14N2S.2ClH/c1-6(2)8-10-7(4-9-3)5-11-8;;/h5-6,9H,4H2,1-3H3;2*1H
2.1.3 InChI Key
GNPOLJYMEXUGCG-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC(C)C1=NC(=CS1)CNC.Cl.Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 1185167-55-8

2. [(2-isopropyl-1,3-thiazol-4-yl)methyl]methylamine 2hcl

3. N-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)methanamine;dihydrochloride

4. 1-(2-isopropyl-1,3-thiazol-4-yl)-n-methylmethanamine Dihydrochloride

5. 2-isopropyl-4-(methylaminomethyl)thiazole Dihydrochloride

6. 2-isopropyl-4(((n-methyl) Amino)methyl)thiazole 2hcl

7. N-methyl-2-(1-methylethyl)-4-thiazolemethanamine Dihydrochloride

8. Ec 937-695-3

9. Schembl16798712

10. 2-isopropyl-4-(n-methylaminomethyl)thiazole Dihydrochloride

11. Bcp11238

12. Cs-d1758

13. 1-(2-isopropyl-1,3-thiazol-4-yl)-n-methylmethanamine Dihydrochlor Ide

14. Mfcd11841218

15. Akos016002769

16. Sb17858

17. Ac-26810

18. As-18961

19. Da-14944

20. Ft-0707520

21. I1057

22. 1-(2-isopropylthiazol-4-yl-n-methylmethanamine

23. A893133

24. N-methyl-2-(1-methylethyl)-4-thiazolemethanamine 2hcl

25. 1-(2-isopropylthiazol-4-yl)-n-methylmethanaminedihydrochloride

26. 1-[2-(1-methylethyl)thiazol-4-yl]-n-methylmethanamine Dihydrochloride

27. Methyl({[2-(propan-2-yl)-1,3-thiazol-4-yl]methyl})amine Dihydrochloride

28. 1-(2-isopropyl-1,3-thiazol-4-yl)-n-methylmethanamine Dihydrochloride Aldrichcpr

29. 1-(2-isopropyl-1,3-thiazol-4-yl)-n-methylmethanamine Dihydrochloride, Aldrichcpr

2.3 Create Date
2010-06-21
3 Chemical and Physical Properties
Molecular Weight 243.20 g/mol
Molecular Formula C8H16Cl2N2S
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass242.0411251 g/mol
Monoisotopic Mass242.0411251 g/mol
Topological Polar Surface Area53.2 Ų
Heavy Atom Count13
Formal Charge0
Complexity117
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count3