Ethyl 4-(furan-2-ylmethylamino)-2-methylpyrimidine-5-carboxylate
TL;DR: Ethyl 4-(furan-2-ylmethylamino)-2-methylpyrimidine-5-carboxylate (CAS 100374-35-4) is a chemical compound with molecular formula C13H15N3O3 and molecular weight 261.11133 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 4-(furan-2-ylmethylamino)-2-methylpyrimidine-5-carboxylate
Also Known As: ethyl 4-(furan-2-ylmethylamino)-2-methylpyrimidine-5-carboxylate
Technical Specifications
| Molecular Formula | C13H15N3O3 |
| Molecular Weight | 261.11133 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 77.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 261.11133 Da |
| Heavy Atoms | 19 |
| Complexity | 301.0 |
| SMILES | CCOC(=O)C1=CN=C(N=C1NCC2=CC=CO2)C |
| InChIKey | NMISFFVIDOSPBD-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 4-(furan-2-ylmethylamino)-2-methylpyrimidine-5-carboxylate
Property Insights of Ethyl 4-(furan-2-ylmethylamino)-2-methylpyrimidine-5-carboxylate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-(furan-2-ylmethylamino)-2-methylpyrimidine-5-carboxylate. The TPSA of 77.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-(furan-2-ylmethylamino)-2-methylpyrimidine-5-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-(furan-2-ylmethylamino)-2-methylpyrimidine-5-carboxylate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethyl 4-(furan-2-ylmethylamino)-2-methylpyrimidine-5-carboxylate?
The CAS number of Ethyl 4-(furan-2-ylmethylamino)-2-methylpyrimidine-5-carboxylate is 100374-35-4.
What is the molecular formula of Ethyl 4-(furan-2-ylmethylamino)-2-methylpyrimidine-5-carboxylate?
The molecular formula of Ethyl 4-(furan-2-ylmethylamino)-2-methylpyrimidine-5-carboxylate is C13H15N3O3.
What is the molecular weight of Ethyl 4-(furan-2-ylmethylamino)-2-methylpyrimidine-5-carboxylate?
The molecular weight of Ethyl 4-(furan-2-ylmethylamino)-2-methylpyrimidine-5-carboxylate is 261.11133 g/mol.
Where can I buy Ethyl 4-(furan-2-ylmethylamino)-2-methylpyrimidine-5-carboxylate?
You can request a quote for Ethyl 4-(furan-2-ylmethylamino)-2-methylpyrimidine-5-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 4-(furan-2-ylmethylamino)-2-methylpyrimidine-5-carboxylate?
Yes, CoreyChem provides custom synthesis services for Ethyl 4-(furan-2-ylmethylamino)-2-methylpyrimidine-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.