CAS 13035-19-3

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Also known as: Piperidin-4-amine, 13035-19-3, 4-piperidinamine, 4-amino piperidine, Piperidin-4-ylamine, 4-piperidineamine

Molecular Formula

C₅H₁₂N₂

Molecular Weight

100.16 g/mol

InChI Key

BCIIMDOZSUCSEN-UHFFFAOYSA-N

1 2D Structure

CAS 13035-19-3

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

piperidin-4-amine

2.1.2 InChI

InChI=1S/C5H12N2/c6-5-1-3-7-4-2-5/h5,7H,1-4,6H2

2.1.3 InChI Key

BCIIMDOZSUCSEN-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1CNCCC1N

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. Piperidin-4-amine

2. 13035-19-3

3. 4-piperidinamine

4. 4-amino Piperidine

5. Piperidin-4-ylamine

6. 4-piperidineamine

7. Pperdn-4-amne

8. 4-amino-piperidine

9. 4- Aminopiperidine

10. Mfcd02179399

11. Schembl62516

12. 4-piperidinamine Dihydrochloride

13. Chembl174570

14. Dtxsid80329842

15. Act05214

16. Albb-027340

17. Bcp01546

18. Zinc2381215

19. Akos000184342

20. Ab11093

21. Am85323

22. Cs-w004330

23. Lf-0513

24. Bp-10687

25. Db-024675

26. Bb 0220565

27. Ft-0617603

28. J-005798

29. J-523968

2.3 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₅H₁₂N₂
Molecular Weight	100.16 g/mol
XLogP3	-0.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	100.100048391 g/mol
Monoisotopic Mass	100.100048391 g/mol
Topological Polar Surface Area	38 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	48
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