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CAS 179474-79-4 manufacturers and suppliers on PharmaCompass

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4CH-024148
Also known as: 1-(3-methoxypropyl)piperidin-4-amine, 179474-79-4, 4-amino-1-(3-methoxypropyl)piperidine, 4-piperidinamine, 1-(3-methoxypropyl)-, Mfcd11104531, Ec 431-950-8
Molecular Formula
C9H20N2O
Molecular Weight
172.27  g/mol
InChI Key
HIXAJGFVNMKLML-UHFFFAOYSA-N

1 2D Structure

4CH-024148

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-(3-methoxypropyl)piperidin-4-amine
2.1.2 InChI
InChI=1S/C9H20N2O/c1-12-8-2-5-11-6-3-9(10)4-7-11/h9H,2-8,10H2,1H3
2.1.3 InChI Key
HIXAJGFVNMKLML-UHFFFAOYSA-N
2.1.4 Canonical SMILES
COCCCN1CCC(CC1)N
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 1-(3-methoxypropyl)piperidin-4-amine

2. 179474-79-4

3. 4-amino-1-(3-methoxypropyl)piperidine

4. 4-piperidinamine, 1-(3-methoxypropyl)-

5. Mfcd11104531

6. Ec 431-950-8

7. Schembl6176615

8. Dtxsid80477332

9. Act09146

10. Bcp13150

11. 1-(3methoxypropyl)-4-piperidinamine

12. Zinc34974470

13. 4-piperidinamine,1-(3-methoxypropyl)

14. Akos009330878

15. Am85328

16. Ds-3987

17. Pb22465

18. Ac-28384

19. Da-21171

20. Sy033501

21. Cs-0052882

22. Ft-0763616

23. En300-65687

24. 1-(3-methoxy-propyl)-piperidin-4-ylamine

25. J-503161

26. Z1262395929

2.3 Create Date
2007-02-07
3 Chemical and Physical Properties
Molecular Weight 172.27 g/mol
Molecular Formula C9H20N2O
XLogP30.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass172.157563266 g/mol
Monoisotopic Mass172.157563266 g/mol
Topological Polar Surface Area38.5 Ų
Heavy Atom Count12
Formal Charge0
Complexity111
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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