2-Methyl-2-propanyl 2-[(cyclopropylamino)methyl]-1-pyrrolidinecarboxylate | CAS No. 1289387-44-5

2-Methyl-2-propanyl 2-[(cyclopropylamino)methyl]-1-pyrrolidinecarboxylate

Basic Information

CAS Number

1289387-44-5

Molecular Formula

C13H24N2O2

Molecular Weight

240.35 g/mol

AD

Basic Physical Properties

CC(C)(C)OC(=O)N1CCCC1CNC2CC2

InChI

InChI=1S/C13H24N2O2/c1-13(2,3)17-12(16)15-8-4-5-11(15)9-14-10-6-7-10/h10-11,14H,4-9H2,1-3H3

InChIKey

SQRRQAVVRXZUMD-UHFFFAOYSA-N

LogP

2.1379

Topological Polar Surface Area

41.57 Ų

Hydrogen Bond Donor/Acceptor

1 / 4

Synonyms & References

English

  • 2-CYCLOPROPYLAMINOMETHYL-PYRROLIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
  • tert-butyl 2-((cyclopropylamino)methyl)pyrrolidine-1-carboxylate
  • tert-butyl 2-[(cyclopropylamino)methyl]pyrrolidine-1-carboxylate

MDL Number

MFCD18837102

FAQ

What are the physical and chemical properties of 2-Methyl-2-propanyl 2-[(cyclopropylamino)methyl]-1-pyrrolidinecarboxylate (CAS: 1289387-44-5)?

2-Methyl-2-propanyl 2-[(cyclopropylamino)methyl]-1-pyrrolidinecarboxylate is a white or off-white crystalline solid with a molecular weight of approximately 288.4 g/mol. It has a pKa of around 6.5, indicating basicity. The compound is poorly soluble in water but soluble in organic solvents such as ethanol and acetone. It exhibits moderate reactivity in nucleophilic substitution reactions and can be used as a chiral building block in organic synthesis.

How is 2-Methyl-2-propanyl 2-[(cyclopropylamino)methyl]-1-pyrrolidinecarboxylate (CAS: 1289387-44-5) typically synthesized?

2-Methyl-2-propanyl 2-[(cyclopropylamino)methyl]-1-pyrrolidinecarboxylate is typically synthesized via a multi-step reaction involving the coupling of 2-cyclopropylaminomethyl-1-pyrrolidinecarboxylic acid with 2-methyl-2-propanol. The reaction is catalyzed by a transition metal complex, such as palladium(II) acetate, in the presence of a base like triethylamine. High yields are achieved with excellent regioselectivity and enantioselectivity under optimized reaction conditions.

What industries use 2-Methyl-2-proanyl 2-[(cyclopropylamino)methyl]-1-pyrrolidinecarboxylate (CAS: 1289387-44-5)?

2-Methyl-2-proanyl 2-[(cyclopropylamino)methyl]-1-pyrrolidinecarboxylate is primarily used in the pharmaceutical and fine chemical industries as a chiral building block. It serves as an intermediate in the synthesis of various chiral compounds, which are essential for drug development. Additionally, it finds applications in the production of chiral resolving agents and in the development of new chiral ligands for asymmetric catalysis.

What precautions should be taken when handling 2-Methyl-2-proanyl 2-[(cyclopropylamino)methyl]-1-pyrrolidinecarboxylate (CAS: 1289387-44-5)?

When handling 2-Methyl-2-proanyl 2-[(cyclopropylamino)methyl]-1-pyrrolidinecarboxylate, it is important to use appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The substance should be stored in a cool, dry place, away from heat sources and direct sunlight. In case of spills, handle them with care and use appropriate spill cleanup procedures as outlined in the Material Safety Data Sheet (MSDS). Always ensure adequate ventilation, preferably in a fume hood, during handling and synthesis to avoid inhalation of vapors.

Related Compounds

You might also like

Compound Q&A

What is 6-Methyl-7-oxabicyclo[4.1.0]heptan-2-one (CAS: 21889-89-4)?

6-Methyl-7-oxabicyclo[4.1.0]heptan-2-one is a cyclic ketone with a molecular for...

21889-89-46-Methyl-7-oxabicycl...
Compound Q&A

What is 4-[(6-Methyl-2-pyrazinyl)oxy]benzoic acid (CAS: 906353-00-2)?

4-[(6-Methyl-2-pyrazinyl)oxy]benzoic acid is a chemical compound with the CAS nu...

906353-00-24-[(6-Methyl-2-pyraz...
Compound Q&A

What is 2-(2-Pyridinyl)-1,3-propanediol (CAS: 49745-42-8)?

2-(2-Pyridinyl)-1,3-propanediol (CAS: 49745-42-8) is a colorless to slightly yel...

49745-42-82-(2-Pyridinyl)-1,3-...
Compound Q&A

What is 2-(6-Chloro-2-pyridinyl)-2-phenylacetonitrile (CAS: 24783-42-4)?

2-(6-Chloro-2-pyridinyl)-2-phenylacetonitrile is an organic compound with the CA...

24783-42-42-(6-Chloro-2-pyridi...
Compound Q&A

What is 2-Oxopropanamide (CAS: 631-66-3)?

2-Oxopropanamide, also known as 2-aminoacrylic acid, is a chemical compound with...

631-66-32-Oxopropanamide
Compound Q&A

What is 2-Methyl-2-propanyl 4-(5-bromo-6-methyl-2-pyridinyl)-1-piperazinecarboxylate (CAS: 1289040-88-5)?

2-Methyl-2-propanyl 4-(5-bromo-6-methyl-2-pyridinyl)-1-piperazinecarboxylate (CA...

1289040-88-52-Methyl-2-propanyl ...
Compound Q&A

What is NAMPT inhibitor-linker 1 (CAS: 2241019-57-6)?

NAMPT inhibitor-linker 1 (CAS: 2241019-57-6) is a chemical compound designed as ...

2241019-57-6NAMPT inhibitor-link...
Compound Q&A

What is (2-(2,2,2-Trifluoroacetyl)pyridin-4-yl)boronic acid (CAS: 1310404-58-0)?

It is a chemical compound with the structure (2-(2,2,2-Trifluoroacetyl)pyridin-4...

1310404-58-0(2-(2,2,2-Trifluoroa...
Compound Q&A

What is 1-(2-Chlorophenyl)-6-(3,3,3-trifluoro-2-methylpropyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one (CAS: 794568-90-4)?

1-(2-Chlorophenyl)-6-(3,3,3-trifluoro-2-methylpropyl)-1,5-dihydro-4H-pyrazolo[3,...

794568-90-41-(2-Chlorophenyl)-6...
Compound Q&A

What is Vinyl(chloromethyl)dimethoxysilane (CAS: 1314981-48-0)?

Vinyl(chloromethyl)dimethoxysilane is an organosilicon compound with the molecul...

1314981-48-0Vinyl(chloromethyl)d...