CAS 356068-86-5

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5 End Use APIs
39 Related Intermediates

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Also known as: 356068-86-5, N-[2-(diethylamino)ethyl]-5-formyl-2,4-dimethyl-1h-pyrrole-3-carboxamide, 8ts2jl9q75, 1h-pyrrole-3-carboxamide, n-(2-(diethylamino)ethyl)-5-formyl-2,4-dimethyl-, N-[2-(diethylamino)ethyl]-2,4-dimethyl-5-formyl-1h-pyrrole-3-carboxamide, 5-formyl-2,4-dimethyl-1h-pyrrole-3-carboxylic acid n-(2-diethylaminoethyl)amide

Molecular Formula

C₁₄H₂₃N₃O₂

Molecular Weight

265.35 g/mol

InChI Key

BRZYBFNUINXZMJ-UHFFFAOYSA-N

FDA UNII

8TS2JL9Q75

1 2D Structure

CAS 356068-86-5

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

N-[2-(diethylamino)ethyl]-5-formyl-2,4-dimethyl-1H-pyrrole-3-carboxamide

2.1.2 InChI

InChI=1S/C14H23N3O2/c1-5-17(6-2)8-7-15-14(19)13-10(3)12(9-18)16-11(13)4/h9,16H,5-8H2,1-4H3,(H,15,19)

2.1.3 InChI Key

BRZYBFNUINXZMJ-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCN(CC)CCNC(=O)C1=C(NC(=C1C)C=O)C

2.2 Other Identifiers

2.2.1 UNII

8TS2JL9Q75

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 356068-86-5

2. N-[2-(diethylamino)ethyl]-5-formyl-2,4-dimethyl-1h-pyrrole-3-carboxamide

3. 8ts2jl9q75

4. 1h-pyrrole-3-carboxamide, N-(2-(diethylamino)ethyl)-5-formyl-2,4-dimethyl-

5. N-[2-(diethylamino)ethyl]-2,4-dimethyl-5-formyl-1h-pyrrole-3-carboxamide

6. 5-formyl-2,4-dimethyl-1h-pyrrole-3-carboxylic Acid N-(2-diethylaminoethyl)amide

7. 1h-pyrrole-3-carboxamide, N-[2-(diethylamino)ethyl]-5-formyl-2,4-dimethyl-

8. Sunitinib Impurity C

9. Unii-8ts2jl9q75

10. Schembl1044420

11. Dtxsid40609672

12. Act01679

13. Bcp09380

14. Mfcd12913910

15. Zinc40456550

16. Akos015896193

17. Ac-8962

18. Cs-w022894

19. Sb62015

20. 5-formyl-2,4-dimethyl-1h-pyrrole-3-carboxylic Acid(2-diethylamino-ethyl)-amide

21. As-18315

22. Db-069236

23. Am20090633

24. Ft-0651839

25. 068d865

26. A822897

27. Q-101398

28. 5-formyl-2,4-dimethyl-1 H-pyrrole-3-carboxylic Acid (2-diethylamino-ethyl)-amide

29. 5-formyl-2,4-dimethyl-1h-pyrrole-3-carboxyiic Acid (2-diethylamino-ethyl)-amide

30. 5-formyl-2,4-dimethyl-1h-pyrrole-3-carboxylic Acid (2-diethylamino-ethyl)-amide

31. 5-formyl-2,4-dimethyl-1h-pyrrole-3-carboxylic Acid (2-diethylamino-ethyl)amide

32. 5-formyl-2,4-dimethyl-1h-pyrrole-3-carboxylic Acid (2-diethylaminoethyl) Amide

33. 5-formyl-2,4-dimethyl-1h-pyrrole-3-carboxylic Acid (2-diethylaminoethyl)-amide

34. 5-formyl-2,4-dimethyl-1h-pyrrole-3-carboxylic Acid (2-diethylaminoethyl)amide

35. 5-formyl-2,4-dimethyl-1h-pyrrole-3-carboxylic Acid (2-diethylarnino-ethyl)-amide

36. 5-formyl-2,4-dimethyl-1h-pyrrole-3-carboxylic Acid(2-diethylaminoethyl)-amide

37. 5-formyl-2,4-dimethyl-1h-pyrrole-3-carboxylic Acid(2-diethylaminoethyl)amide

38. 5-formyl-2,4-dimethyl-1h-pyrrole-3-carboxylic Acid, N-(2-diethylaminoethyl)amide

2.4 Create Date

2007-12-05

3 Chemical and Physical Properties

Molecular Formula	C₁₄H₂₃N₃O₂
Molecular Weight	265.35 g/mol
XLogP3	1.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	7
Exact Mass	265.17902698 g/mol
Monoisotopic Mass	265.17902698 g/mol
Topological Polar Surface Area	65.2 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	305
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	1