75985-45-4 | 2-Pyrimidinemethanamine

Packsize	Purity	Availability	Price	Discounted Price
250mg	95%	in stock	$8.00	$5.00
1g	95%	in stock	$14.00	$10.00
5g	95%	in stock	$46.00	$33.00
10g	95%	in stock	$84.00	$59.00
25g	95%	in stock	$176.00	$124.00

Description

• Catalog Number: AC54879
• Chemical Name: 2-Pyrimidinemethanamine
• CAS Number: 75985-45-4
• Molecular Formula: C5H7N3
• Molecular Weight: 109.1292
• MDL Number: MFCD27920637
• SMILES: NCc1ncccn1

Computed Properties

• Complexity: 58.7
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 8
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: -0.9

Upstream Synthesis Route

2-Pyrimidinemethanamine, also known as 2-Aminopyrimidine, is a versatile compound widely used in chemical synthesis. It serves as a key building block in the production of various pharmaceuticals, agrochemicals, and other fine chemicals. Due to its unique structural properties, 2-Pyrimidinemethanamine exhibits reactivity towards a range of functional groups, enabling its utility in the creation of diverse chemical structures. Specifically, this compound is commonly employed in the preparation of heterocyclic compounds, including pyrimidines, which are essential scaffolds in drug discovery and development. Additionally, 2-Pyrimidinemethanamine can participate in various reactions, such as acylation, alkylation, and condensation, allowing for the synthesis of complex molecular structures with specific functionalities. Its role as a versatile synthetic intermediate positions it as a valuable asset in the field of organic chemistry, contributing to the advancement of innovative chemical processes and the creation of novel compounds.

Literature

• Molecular dynamics simulations and MM/GBSA methods to investigate binding mechanisms of aminomethylpyrimidine inhibitors with DPP-IV.

  Bioorganic & medicinal chemistry letters 20111115

• Stereoselectivity and regioselectivity in nucleophilic ring opening in derivatives of 3-phenylisoxazolo[2,3-a]pyrimidine. Unpredicted dimerization and ring transformation. Syntheses of derivatives of pyrimidinylmethylamine, pyrimidinylmethylamino acid amides, and alpha-amino-2-pyrimidinylacetamides.

  The Journal of organic chemistry 20040723

• An aminomethylpyrimidine DPP-IV inhibitor with improved properties.

  Bioorganic & medicinal chemistry letters 20040705