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2D Structure
Also known as: 38957-41-4, Nandron, Pentoil, 4-ethoxy-2-methyl-5-morpholino-3(2h)-pyridazinone, M73101, 3(2h)-pyridazinone, 4-ethoxy-2-methyl-5-morpholino-
Molecular Formula
C11H17N3O3
Molecular Weight
239.27  g/mol
InChI Key
URJQOOISAKEBKW-UHFFFAOYSA-N
FDA UNII
V93U9DH62C

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
4-ethoxy-2-methyl-5-morpholin-4-ylpyridazin-3-one
2.1.2 InChI
InChI=1S/C11H17N3O3/c1-3-17-10-9(8-12-13(2)11(10)15)14-4-6-16-7-5-14/h8H,3-7H2,1-2H3
2.1.3 InChI Key
URJQOOISAKEBKW-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CCOC1=C(C=NN(C1=O)C)N2CCOCC2
2.2 Other Identifiers
2.2.1 UNII
V93U9DH62C
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 4-ethoxy-2-methyl-5-morpholino-3(2h)-pyridazinone

2. M 73101

3. M-73101

4. M73101

2.3.2 Depositor-Supplied Synonyms

1. 38957-41-4

2. Nandron

3. Pentoil

4. 4-ethoxy-2-methyl-5-morpholino-3(2h)-pyridazinone

5. M73101

6. 3(2h)-pyridazinone, 4-ethoxy-2-methyl-5-morpholino-

7. 4-ethoxy-2-methyl-5-(4-morpholinyl)-3(2h)-pyridazinone

8. V93u9dh62c

9. Emorfazona

10. Emorfazonum

11. Pentoyl

12. Emorfazone [inn:jan]

13. Emorfazone [inn-french]

14. Emorfazonum [inn-latin]

15. Emorfazona [inn-spanish]

16. Einecs 254-220-9

17. M 73101

18. Brn 0995465

19. Unii-v93u9dh62c

20. 4-ethoxy-2-methyl-5-morpholin-4-ylpyridazin-3-one

21. Pentoil (tn)

22. Emorfazone [mi]

23. Emorfazone [inn]

24. Emorfazone [jan]

25. Dsstox_cid_2981

26. Emorfazone (jp17/inn)

27. Dsstox_rid_97544

28. Emorfazone [who-dd]

29. Dsstox_gsid_22981

30. M-73101

31. Schembl26203

32. Zinc1349

33. Chembl2103954

34. Dtxsid0022981

35. Chebi:31535

36. 3(2h)-pyridazinone, 4-ethoxy-2-methyl-5-(4-morpholinyl)-

37. Tox21_113708

38. Ncgc00249932-01

39. Ph011085

40. Cas-38957-41-4

41. D01353

42. Sr-01000944985

43. Sr-01000944985-1

44. Q27291687

45. 4-(ethyloxy)-2-methyl-5-morpholin-4-ylpyridazin-3(2h)-one

2.4 Create Date
2005-03-25
3 Chemical and Physical Properties
Molecular Weight 239.27 g/mol
Molecular Formula C11H17N3O3
XLogP30
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass239.12699141 g/mol
Monoisotopic Mass239.12699141 g/mol
Topological Polar Surface Area54.4 Ų
Heavy Atom Count17
Formal Charge0
Complexity359
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1