1-Pyrrolidinamine

Synopsis, Chemistry

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Also known as: 1-aminopyrrolidine, Pyrrolidin-1-amine, 16596-41-1, N-aminopyrrolidine, Pyrrolidine, 1-amino-, Aminopyrrolidine

Molecular Formula

C₄H₁₀N₂

Molecular Weight

86.14 g/mol

InChI Key

SBMSLRMNBSMKQC-UHFFFAOYSA-N

FDA UNII

DF424U7HM6

1 2D Structure

1-Pyrrolidinamine

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

pyrrolidin-1-amine

2.1.2 InChI

InChI=1S/C4H10N2/c5-6-3-1-2-4-6/h1-5H2

2.1.3 InChI Key

SBMSLRMNBSMKQC-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1CCN(C1)N

2.2 Other Identifiers

2.2.1 UNII

DF424U7HM6

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 1-aminopyrrolidine

2. Pyrrolidin-1-amine

3. 16596-41-1

4. N-aminopyrrolidine

5. Pyrrolidine, 1-amino-

6. Aminopyrrolidine

7. Df424u7hm6

8. Nsc-80647

9. Pyrrolidin-1-ylamine

10. Pyrrolidylamine

11. Nsc80647

12. Nsc 80647

13. Unii-df424u7hm6

14. Dtxsid40168052

15. Albb-032445

16. Mfcd07368381

17. Zinc19167244

18. Akos003582850

19. Db-005671

20. Bb 0218179

21. Ft-0601174

22. P2560

23. A26943

24. F13227

25. 596a411

26. A810683

27. J-524150

2.4 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₄H₁₀N₂
Molecular Weight	86.14 g/mol
XLogP3	-0.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	86.084398327 g/mol
Monoisotopic Mass	86.084398327 g/mol
Topological Polar Surface Area	29.3 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	38.8
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