1-(3-hydroxidmethylpyridine)-2-phenyl-4-methyl-piperazine

Also known as: 61337-89-1, 2-(4-methyl-2-phenyl-1-piperazinyl)-3-pyridinemethanol, 337376-18-8, (2-(4-methyl-2-phenylpiperazin-1-yl)pyridin-3-yl)methanol, 1-(3-hydroxymethylpyridyl-2)-2-phenyl-4-methylpyperazine, [2-(4-methyl-2-phenylpiperazin-1-yl)pyridin-3-yl]methanol

Molecular Formula

C₁₇H₂₁N₃O

Molecular Weight

283.37 g/mol

InChI Key

PYZPABZGIRHQTA-UHFFFAOYSA-N

FDA UNII

XRO2GE880O

1 2D Structure

1-(3-hydroxidmethylpyridine)-2-phenyl-4-methyl-piperazine

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

[2-(4-methyl-2-phenylpiperazin-1-yl)pyridin-3-yl]methanol

2.1.2 InChI

InChI=1S/C17H21N3O/c1-19-10-11-20(17-15(13-21)8-5-9-18-17)16(12-19)14-6-3-2-4-7-14/h2-9,16,21H,10-13H2,1H3

2.1.3 InChI Key

PYZPABZGIRHQTA-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CN1CCN(C(C1)C2=CC=CC=C2)C3=C(C=CC=N3)CO

2.2 Other Identifiers

2.2.1 UNII

XRO2GE880O

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 61337-89-1

2. 2-(4-methyl-2-phenyl-1-piperazinyl)-3-pyridinemethanol

3. 337376-18-8

4. (2-(4-methyl-2-phenylpiperazin-1-yl)pyridin-3-yl)methanol

5. 1-(3-hydroxymethylpyridyl-2)-2-phenyl-4-methylpyperazine

6. [2-(4-methyl-2-phenylpiperazin-1-yl)pyridin-3-yl]methanol

7. Xro2ge880o

8. 3-pyridinemethanol, 2-(4-methyl-2-phenyl-1-piperazinyl)-

9. 2-(4-methyl-2-phenylpiperazin-1-yl)pyridine-3-methanol

10. 1-(3-(hydroxymethyl)pyridin-2-yl)-4-methyl-2-phenylpiperazine

11. 1-(3-hydroxymethyl Pyridin-2-yl)-4-methyl-2-phenyl Piperazine

12. [2-[(2rs)-4-methyl-2-phenylpiperazin-1-yl]pyridin-3-yl]methanol

13. Mirtazapine Impurity B

14. Unii-xro2ge880o

15. Ec 700-296-8

16. 2-(4-methyl-2-phenylpiperazino)pyridine-3-methanol

17. Acyclomirtazapine Alcohol

18. Schembl1325599

19. 1-(3-hydroxidmethylpyridine)-2-phenyl-4-methyl-piperazine

20. 1-(3-hydroxymethyl-2-pyridyl)-4-methyl-2-phenylpiperazine

21. Dtxsid901036336

22. Amy40875

23. Mfcd08063948

24. Akos010505275

25. Diethyl3,4-pyrroledicarboxylate

26. Ac-15710

27. Ac-23364

28. Ds-10746

29. Db-018516

30. Db-053847

31. Cs-0313951

32. Ft-0640747

33. Ft-0727774

34. Mirtazapine Impurity B [ep Impurity]

35. F14603

36. 337m891

37. A868737

38. A875208

39. 1-(3-hydroxymethylpyridyl-2)-4-methyl-2-phenyl-piperazine

40. 1-(3-hydroxymethyl Pyridin-2-yl)-4-methyl-2-phenylpiperazine

41. 1-(3-hydroxymethyl Pyridyl-2)-4-methyl-2-phenyl-piperazine

42. 1-(3-hydroxymethylpyridin-2-yl)-4-methyl-2-phenyl Piperazine

2.4 Create Date

2006-10-25

3 Chemical and Physical Properties

Molecular Formula	C₁₇H₂₁N₃O
Molecular Weight	283.37 g/mol
XLogP3	1.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	283.168462302 g/mol
Monoisotopic Mass	283.168462302 g/mol
Topological Polar Surface Area	39.6 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	319
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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CAS Number

61337-89-1

Intermediate Name

1-(3-Hydroxymethylpyridin-2-yl)-4-m...

About the Company

Established in 2003 with small pilot plant and came in to commercial production in 2013 in the name of Al...

Established in 2003 with small pilot plant and came in to commercial production in 2013 in the name of Allchem Laboratories, it is an independent privately owned company.Name changed from Allchem Laboratories to Allchem Lifescience Pvt. Ltd in April-2017.We are Allchem Lifescience Pvt Ltd., a fully cGMP compliant pharmaceutical intermediates plant located in the outskirts of Vadodara, Gujarat, India. (Location :400 km north of Mumbai at Vadodara, Gujarat, INDIA).

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CAS Number

61337-89-1

Intermediate Name

1-(3-hydroximethylpiridin-2-yl)-4-m...

About the Company

MENADIONA is an independent privately-owned company, founded in 1970. Ever since, the company has been in...

MENADIONA is an independent privately-owned company, founded in 1970. Ever since, the company has been involved in manufacturing active ingredients (APIs) and key intermediates for the Pharmaceutical, Veterinary, Plant Health and Nutraceutical industries. In addition, Aziridine and its derivatives is one of the most outstanding business units for MENADIONA. Besides, we offer custom and contract manufacturing services through our Fine Chemical Division. With a highly qualified team and two manufacturing plants in Spain, MENADIONA is characterized by its strong worldwide export volume, which accounts for more than 80% of its sales.

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Riddhi Pharma

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CAS Number

61337-89-1

Intermediate Name

1-(3-HYDROXY METHYL PYRIDYL-2)-2-PH...

About the Company

Riddhi Pharma was set up in 1997 as a Manufacturer of API’s Intermediates and Fine Chemicals, especiall...

Riddhi Pharma was set up in 1997 as a Manufacturer of API’s Intermediates and Fine Chemicals, especially in the field of Friedel Crafts Reaction / Bromination and Chlorination. The establishment of the company itself was motivated by a strong desire to provide Quality Bulk API’s Intermediates in the most cost-effective way. Right our inception, we are focused on exploiting the potential of the Pharmaceutical Industry and our articulate vision has made us a significant player in Bulk API’s Sector.

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