1-[(2S,5R)-2-Methyl-5-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)-1-piperidinyl]-2-propen-1-one | CAS No. 1792180-81-4

1-[(2S,5R)-2-Methyl-5-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)-1-piperidinyl]-2-propen-1-one

Basic Information

CAS Number

1792180-81-4

Molecular Formula

C15H19N5O

Molecular Weight

285.35 g/mol

AD

Basic Physical Properties

Density

1.272±0.06 g/cm3(Predicted)

C[C@H]1CC[C@H](CN1C(=O)C=C)Nc2c3cc[nH]c3ncn2

InChI

InChI=1S/C15H19N5O/c1-3-13(21)20-8-11(5-4-10(20)2)19-15-12-6-7-16-14(12)17-9-18-15/h3,6-7,9-11H,1,4-5,8H2,2H3,(H2,16,17,18,19)/t10-,11+/m0/s1

InChIKey

CBRJPFGIXUFMTM-WDEREUQCSA-N

LogP

1.9352999999999996

Topological Polar Surface Area

73.91 Ų

Hydrogen Bond Donor/Acceptor

2 / 6

Complexity

402

Synonyms & References

English

  • 1-((2S,5R)-5-((7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)-2-methylpiperidin-1-yl)prop-2-en-1-one
  • 2OYE00PC25
  • PF06651600
  • ritlecitinib (proposed INN)
  • GTPL9559
  • BCP24778
  • example 5 [WO2015083028]
  • DB14924
  • compound 11 [PMID: 28139931]
  • S8538
  • PF06651600;PF 06651600
  • 1-[(2S,5R)-2-Methyl-5-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)-1-piperidinyl]-2-propen-1-one malonate
  • 1-[(2S,5R)-2-methyl-5-
  • Ritlecitinib

MDL Number

MFCD30343868

FAQ

What regulatory guidelines apply to 1-[(2S,5R)-2-Methyl-5-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)-1-piperidinyl]-2-propen-1-one (CAS: 1792180-81-4)?

The compound 1-[(2S,5R)-2-Methyl-5-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)-1-piperidinyl]-2-propen-1-one (CAS: 1792180-81-4) falls under various regulatory frameworks including REACH for registration, evaluation, authorization, and restriction of chemicals in the EU. In the U.S., FDA regulations may apply for pharmaceutical applications, while EPA guidelines might be relevant for environmental safety. It is crucial to comply with local and international regulations to ensure safe handling and disposal.

Are there alternatives to 1-[(2S,5R)-2-Methyl-5-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)-1-piperidinyl]-2-propen-1-one (CAS: 1792180-81-4) in synthesis?

For the synthesis of 1-[(2S,5R)-2-Methyl-5-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)-1-piperidinyl]-2-propen-1-one (CAS: 1792180-81-4), alternative reagents such as other piperidines or pyrimidine derivatives may be considered. Isomers and analogs like 1-[(3S,5R)-3-Methyl-5-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)-1-piperidinyl]-2-propen-1-one can serve as alternatives, but their use should be evaluated based on the specific application and synthesis conditions.

What is the market or research trend for 1-[(2S,5R)-2-Methyl-5-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)-1-piperidinyl]-2-propen-1-one (CAS: 1792180-81-4)?

The market for 1-[(2S,5R)-2-Methyl-5-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)-1-piperidinyl]-2-propen-1-one (CAS: 1792180-81-4) is currently focused on pharmaceutical and research applications. There is ongoing research into its potential therapeutic applications, particularly in oncology. Market trends indicate an increasing demand for such compounds due to their unique biological properties, driving further development and investigation.

How should waste containing 1-[(2S,5R)-2-Methyl-5-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)-1-piperidinyl]-2-propen-1-one (CAS: 1792180-81-4) be handled?

Waste containing 1-[(2S,5R)-2-Methyl-5-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)-1-piperidinyl]-2-propen-1-one (CAS: 1792180-81-4) should be collected in appropriate containers, labeled with the chemical name and CAS number. Disposal should follow local and international hazardous waste regulations. Professional waste disposal services are recommended to ensure safe and environmentally friendly handling. Proper environmental protection measures must be implemented to prevent contamination and protect public health.

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