CAS 39633-82-4

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BUILDING BLOCK

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2 End Use APIs
2 Related Intermediates

Chemistry

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Also known as: 39633-82-4, [1,4'-bipiperidine]-4'-carboxamide, 1,4'-bipiperidine-4'-carboxamide, [1,4']bipiperidinyl-4'-carboxylic acid amide, 1,4'-bipiperidinyl-4'-carboxamide, 4-piperidin-1-ylpiperidine-4-carboxamide

Molecular Formula

C₁₁H₂₁N₃O

Molecular Weight

211.30 g/mol

InChI Key

AUXZEVXPRCVGAO-UHFFFAOYSA-N

FDA UNII

5JKN1A3T8A

1 2D Structure

CAS 39633-82-4

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

4-piperidin-1-ylpiperidine-4-carboxamide

2.1.2 InChI

InChI=1S/C11H21N3O/c12-10(15)11(4-6-13-7-5-11)14-8-2-1-3-9-14/h13H,1-9H2,(H2,12,15)

2.1.3 InChI Key

AUXZEVXPRCVGAO-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1CCN(CC1)C2(CCNCC2)C(=O)N

2.2 Other Identifiers

2.2.1 UNII

5JKN1A3T8A

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 39633-82-4

2. [1,4'-bipiperidine]-4'-carboxamide

3. 1,4'-bipiperidine-4'-carboxamide

4. [1,4']bipiperidinyl-4'-carboxylic Acid Amide

5. 1,4'-bipiperidinyl-4'-carboxamide

6. 4-piperidin-1-ylpiperidine-4-carboxamide

7. 5jkn1a3t8a

8. Nsc-76044

9. Nsc 76044

10. Nsc76044

11. Einecs 254-548-2

12. 4-carbamoyl-4-(1-piperidinyl)piperidine

13. Unii-5jkn1a3t8a

14. 4-(1-piperidinyl)-4-(aminocarbonyl)piperidine

15. Schembl1127702

16. Dtxsid30192740

17. Zinc266396

18. 4-carbamoyl-4-piperidino-piperidine

19. Albb-023498

20. Bbl001678

21. Mfcd01631148

22. Stk664283

23. Akos000482610

24. Ac-9176

25. Sb43211

26. 4-(1-piperidino)-4-piperidinecarboxamide

27. 4-carbamoyl-4-piperidinopiperidine

28. Ts-03017

29. (1,4-bipiperidine)-4-carboxamide

30. Db-049444

31. Cs-0199955

32. Eu-0066587

33. Ft-0605392

34. (1,4'-bipiperidine)-4'-carboxamide, Aldrichcpr

35. A824656

36. Sr-01000597189

37. 4-(piperidin-1-yl)piperidine-4-carboxamide

38. Sr-01000597189-1

2.4 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₁₁H₂₁N₃O
Molecular Weight	211.30 g/mol
XLogP3	0
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	211.168462302 g/mol
Monoisotopic Mass	211.168462302 g/mol
Topological Polar Surface Area	58.4 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	230
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