CAS 882167-77-3

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9 Related Intermediates

Chemistry

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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

CAS 882167-77-3

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 Formula	C₇H₈Cl₂N₂O
Molecular Weight	207.05 g/mol
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	206.0013683 g/mol
Monoisotopic Mass	206.0013683 g/mol
Topological Polar Surface Area	42 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	151
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2