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Suanfarma Suanfarma

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Technical details about Dinorvenlafaxine, learn more about the structure, uses, toxicity, action, side effects and more

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2D Structure
1. Also known as: 93413-77-5, 1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol, Dinorvenlafaxine, 1-(2-amino-1-(4-methoxyphenyl)ethyl)cyclohexanol, D,l-n,n-didesmethyl venlafaxine, 1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol
Molecular Formula
C15H23NO2
Molecular Weight
249.35  g/mol
InChI Key
SUQHIQRIIBKNOR-UHFFFAOYSA-N
FDA UNII
3235EO37UJ

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol
2.1.2 InChI
InChI=1S/C15H23NO2/c1-18-13-7-5-12(6-8-13)14(11-16)15(17)9-3-2-4-10-15/h5-8,14,17H,2-4,9-11,16H2,1H3
2.1.3 InChI Key
SUQHIQRIIBKNOR-UHFFFAOYSA-N
2.1.4 Canonical SMILES
COC1=CC=C(C=C1)C(CN)C2(CCCCC2)O
2.2 Other Identifiers
2.2.1 UNII
3235EO37UJ
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 93413-77-5

2. 1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol

3. Dinorvenlafaxine

4. 1-(2-amino-1-(4-methoxyphenyl)ethyl)cyclohexanol

5. D,l-n,n-didesmethyl Venlafaxine

6. 1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol

7. N,n-didesmethylvenlafaxine, (+/-)-

8. Chembl98158

9. Chebi:83446

10. 3235eo37uj

11. 1-(2-amino-1-(p-methoxyphenyl)ethyl)cyclohexanol

12. Cyclohexanol, 1-(2-amino-1-(4-methoxyphenyl)ethyl)-

13. 2-(4-methoxyphenyl)-2-(1-hydroxycyclohexyl)-ethylamine

14. 1-[2-amino-1-(p-methoxyphenyl)ethyl]cyclohexanol

15. 1-(2-amino-1-(4-methoxy Phenyl)ethyl)cyclohexanol

16. Discontinued. Please See A611968

17. N,n-didesvenlafaxine

18. 1-[2-amino-1-(4-methoxy Phenyl)ethyl]cyclohexanol

19. 1-(2-amino-1-(4-methoxyphenyl)ethyl)cyclohexan-1-ol

20. Unii-3235eo37uj

21. Venlafaxine Hydrochloride Impurity C [ep]

22. Venlafaxine Ep Impurity C

23. N,n-didesmethyl Venlafaxine

24. Schembl637250

25. Didesmethyl Venlafaxine, N,n-

26. (discontinued) See M745032

27. Dtxsid50891440

28. Venlafaxine Hydrochloride Impurity, Didesmethyl Venlafaxine- [usp]

29. 3,3-thiodipropionicaciddimethylester

30. Bdbm50010888

31. Mfcd07367622

32. Rac Cis-moxifloxacin-d4 Acyl Sulfate

33. Akos015994493

34. Ss-3413

35. Cs-0357626

36. Ft-0642244

37. 1-[2-amino-1(p-methoxyphenyl)ethyl]cyclohexanol

38. 1-[1-(4-methoxyphenyl)-2-aminoethyl]cyclohexanol

39. 413a775

40. A844587

41. 1-[2-amino-1-(4-methoxyphenyl)ethyl] Cyclohexanol

42. 1-[2-amino-1-(4-methoxyphenyl)ethyl]-cyclohexanol

43. 1-[2-amino-1-(p-methoxyphenyl)ethyl] Cyclohexanol

44. Q27156830

45. Venlafaxine Hydrochloride Impurity C [ep Impurity]

46. 1-[2-amino-1-(4-methoxy-phenyl)-ethyl]-cyclohexanol (hcl)

47. Venlafaxine Hydrochloride Impurity, Didesmethyl Venlafaxine- [usp Impurity]

2.4 Create Date
2006-10-25
3 Chemical and Physical Properties
Molecular Weight 249.35 g/mol
Molecular Formula C15H23NO2
XLogP32.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass249.172878976 g/mol
Monoisotopic Mass249.172878976 g/mol
Topological Polar Surface Area55.5 Ų
Heavy Atom Count18
Formal Charge0
Complexity243
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Pharmacology and Biochemistry
4.1 ATC Code

N06AX16

S66 | EAWAGTPS | Parent-Transformation Product Pairs from Eawag | DOI:10.5281/zenodo.3754448


N06AX16

S66 | EAWAGTPS | Parent-Transformation Product Pairs from Eawag | DOI:10.5281/zenodo.3754448


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