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2D Structure
Also known as: 882167-77-3, 4-chloro-n-methylpyridine-2-carboxamide hydrochloride, 4-chloro-n-methylpyridine-2-carboxamide;hydrochloride, 4-chloro-n-methylpyridine-2-carboxamide hcl, 4-chloro-n-methylpicolinamidehydrochloride, Ec 692-719-7
Molecular Formula
C7H8Cl2N2O
Molecular Weight
207.05  g/mol
InChI Key
XGHILPUCRYAWIN-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
4-chloro-N-methylpyridine-2-carboxamide;hydrochloride
2.1.2 InChI
InChI=1S/C7H7ClN2O.ClH/c1-9-7(11)6-4-5(8)2-3-10-6;/h2-4H,1H3,(H,9,11);1H
2.1.3 InChI Key
XGHILPUCRYAWIN-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CNC(=O)C1=NC=CC(=C1)Cl.Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 882167-77-3

2. 4-chloro-n-methylpyridine-2-carboxamide Hydrochloride

3. 4-chloro-n-methylpyridine-2-carboxamide;hydrochloride

4. 4-chloro-n-methylpyridine-2-carboxamide Hcl

5. 4-chloro-n-methylpicolinamidehydrochloride

6. Ec 692-719-7

7. Schembl700397

8. 4-chloro-n-methyl-pyridine-2-carboxamide Hydrochloride

9. 4-chloro-n-methylpyridine-2-carboxamide,hydrochloride

10. Dtxsid20675759

11. 4-chloro-n-methylpicolinamide Hcl

12. 4-chloro-n-methylpyridine-2-carboxamide Hydrochloride (1:1)

13. 4-chloro-n-methylpyridine-2-carboxamide--hydrogen Chloride (1/1)

14. Amy40275

15. Bcp10788

16. Cs-m2759

17. Mfcd13368182

18. Akos016001115

19. Ac-31057

20. Ds-12879

21. Ft-0664946

22. F15257

23. 4-chloro-(2-pyridyl)-n-methylcarboxamide

24. A842502

2.3 Create Date
2010-07-26
3 Chemical and Physical Properties
Molecular Weight 207.05 g/mol
Molecular Formula C7H8Cl2N2O
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass206.0013683 g/mol
Monoisotopic Mass206.0013683 g/mol
Topological Polar Surface Area42 Ų
Heavy Atom Count12
Formal Charge0
Complexity151
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2