(1-Methylpiperidin-4-yl)methyl (1-hydroxycyclohexyl)(phenyl)acetate
TL;DR: (1-Methylpiperidin-4-yl)methyl (1-hydroxycyclohexyl)(phenyl)acetate (CAS 101564-13-0) is a chemical compound with molecular formula C21H31NO3 and molecular weight 345.2304 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1-methylpiperidin-4-yl)methyl 2-(1-hydroxycyclohexyl)-2-phenylacetate
Also Known As: 1-Hydroxy-alpha-phenylcyclohexaneacetic acid (1-methyl-4-piperidyl)methyl ester, (1-Methyl-4-piperidyl)methyl(1-hydroxycyclohexyl)phenylacetate, (1-methylpiperidin-4-yl)methyl 2-(1-hydroxycyclohexyl)-2-phenylacetate, (1-Methylpiperidin-4-yl)methyl (1-hydroxycyclohexyl)(phenyl)acetate, (1-methyl-4-piperidyl)methyl (1-hydroxycyclohexyl)phenylacetate
Technical Specifications
| Molecular Formula | C21H31NO3 |
| Molecular Weight | 345.2304 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 345.2304 Da |
| Heavy Atoms | 25 |
| Complexity | 419.0 |
| SMILES | CN1CCC(CC1)COC(=O)C(C2=CC=CC=C2)C3(CCCCC3)O |
| InChIKey | BDEINROOCIBWNG-UHFFFAOYSA-N |
Chemical Property Profile of (1-Methylpiperidin-4-yl)methyl (1-hydroxycyclohexyl)(phenyl)acetate
Property Insights of (1-Methylpiperidin-4-yl)methyl (1-hydroxycyclohexyl)(phenyl)acetate
The XLogP value of 4.0 indicates that (1-Methylpiperidin-4-yl)methyl (1-hydroxycyclohexyl)(phenyl)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, (1-Methylpiperidin-4-yl)methyl (1-hydroxycyclohexyl)(phenyl)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1-Methylpiperidin-4-yl)methyl (1-hydroxycyclohexyl)(phenyl)acetate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (1-Methylpiperidin-4-yl)methyl (1-hydroxycyclohexyl)(phenyl)acetate?
The CAS number of (1-Methylpiperidin-4-yl)methyl (1-hydroxycyclohexyl)(phenyl)acetate is 101564-13-0.
What is the molecular formula of (1-Methylpiperidin-4-yl)methyl (1-hydroxycyclohexyl)(phenyl)acetate?
The molecular formula of (1-Methylpiperidin-4-yl)methyl (1-hydroxycyclohexyl)(phenyl)acetate is C21H31NO3.
What is the molecular weight of (1-Methylpiperidin-4-yl)methyl (1-hydroxycyclohexyl)(phenyl)acetate?
The molecular weight of (1-Methylpiperidin-4-yl)methyl (1-hydroxycyclohexyl)(phenyl)acetate is 345.2304 g/mol.
Where can I buy (1-Methylpiperidin-4-yl)methyl (1-hydroxycyclohexyl)(phenyl)acetate?
You can request a quote for (1-Methylpiperidin-4-yl)methyl (1-hydroxycyclohexyl)(phenyl)acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (1-Methylpiperidin-4-yl)methyl (1-hydroxycyclohexyl)(phenyl)acetate?
Yes, CoreyChem provides custom synthesis services for (1-Methylpiperidin-4-yl)methyl (1-hydroxycyclohexyl)(phenyl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.