1-Methylpiperidin-4-yl 1-phenylcyclopentanecarboxylate
TL;DR: 1-Methylpiperidin-4-yl 1-phenylcyclopentanecarboxylate (CAS 3613-68-1) is a chemical compound with molecular formula C18H25NO2 and molecular weight 287.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-methylpiperidin-4-yl) 1-phenylcyclopentane-1-carboxylate
Also Known As: 1-methylpiperidin-4-yl 1-phenylcyclopentanecarboxylate, N-Methyl-4-piperidyl 1-phenylcyclopentanecarboxylate, 1-Methyl-4-piperidinyl 1-phenylcyclopentanecarboxylate, 1'-Methyl-4'-piperidinyl 1-phenylcyclopentanecarboxylate, 1-Methyl-4-piperidinyl 1-phenylcyclopentanecarboxylate #
| Molecular Formula | C18H25NO2 |
|---|---|
| Molecular Weight | 287.19 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 287.18854 |
| Heavy Atoms | 21 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 3613-68-1 |
|---|---|
| SMILES | CN1CCC(CC1)OC(=O)C2(CCCC2)C3=CC=CC=C3 |
| InChIKey | PWMIFBVIRQUHHB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methylpiperidin-4-yl 1-phenylcyclopentanecarboxylate (CAS 3613-68-1), with molecular formula C18H25NO2 and molecular weight 287.19 g/mol. IUPAC: (1-methylpiperidin-4-yl) 1-phenylcyclopentane-1-carboxylate.
Chemical Property Profile of 1-Methylpiperidin-4-yl 1-phenylcyclopentanecarboxylate
Property Insights of 1-Methylpiperidin-4-yl 1-phenylcyclopentanecarboxylate
The XLogP value of 3.7 indicates that 1-Methylpiperidin-4-yl 1-phenylcyclopentanecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 1-Methylpiperidin-4-yl 1-phenylcyclopentanecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methylpiperidin-4-yl 1-phenylcyclopentanecarboxylate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Methylpiperidin-4-yl 1-phenylcyclopentanecarboxylate?
The CAS number of 1-Methylpiperidin-4-yl 1-phenylcyclopentanecarboxylate is 3613-68-1.
What is the molecular formula of 1-Methylpiperidin-4-yl 1-phenylcyclopentanecarboxylate?
The molecular formula of 1-Methylpiperidin-4-yl 1-phenylcyclopentanecarboxylate is C18H25NO2.
What is the molecular weight of 1-Methylpiperidin-4-yl 1-phenylcyclopentanecarboxylate?
The molecular weight of 1-Methylpiperidin-4-yl 1-phenylcyclopentanecarboxylate is 287.19 g/mol.
Where can I buy 1-Methylpiperidin-4-yl 1-phenylcyclopentanecarboxylate?
You can request a quote for 1-Methylpiperidin-4-yl 1-phenylcyclopentanecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methylpiperidin-4-yl 1-phenylcyclopentanecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 1-Methylpiperidin-4-yl 1-phenylcyclopentanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.