Methyl 3-(cyclooctylamino)-2-methylpropanoate
TL;DR: Methyl 3-(cyclooctylamino)-2-methylpropanoate (CAS 1009577-74-5) is a chemical compound with molecular formula C13H25NO2 and molecular weight 227.18852 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 3-(cyclooctylamino)-2-methylpropanoate
Also Known As: methyl 3-(cyclooctylamino)-2-methylpropanoate, Methyl 3-(cyclooctylamino)-2-methyl-propanoate
Technical Specifications
| Molecular Formula | C13H25NO2 |
| Molecular Weight | 227.18852 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 227.18852 Da |
| Heavy Atoms | 16 |
| Complexity | 198.0 |
| SMILES | CC(CNC1CCCCCCC1)C(=O)OC |
| InChIKey | DHZIMSCBFKTLAA-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 3-(cyclooctylamino)-2-methylpropanoate
Property Insights of Methyl 3-(cyclooctylamino)-2-methylpropanoate
The XLogP value of 3.6 indicates that Methyl 3-(cyclooctylamino)-2-methylpropanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, Methyl 3-(cyclooctylamino)-2-methylpropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-(cyclooctylamino)-2-methylpropanoate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Methyl 3-(cyclooctylamino)-2-methylpropanoate?
The CAS number of Methyl 3-(cyclooctylamino)-2-methylpropanoate is 1009577-74-5.
What is the molecular formula of Methyl 3-(cyclooctylamino)-2-methylpropanoate?
The molecular formula of Methyl 3-(cyclooctylamino)-2-methylpropanoate is C13H25NO2.
What is the molecular weight of Methyl 3-(cyclooctylamino)-2-methylpropanoate?
The molecular weight of Methyl 3-(cyclooctylamino)-2-methylpropanoate is 227.18852 g/mol.
Where can I buy Methyl 3-(cyclooctylamino)-2-methylpropanoate?
You can request a quote for Methyl 3-(cyclooctylamino)-2-methylpropanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 3-(cyclooctylamino)-2-methylpropanoate?
Yes, CoreyChem provides custom synthesis services for Methyl 3-(cyclooctylamino)-2-methylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.