![Methyl 1-[(3-cyanophenyl)methyl]piperidine-4-carboxylate structure](/static/products/101/1016506-74-3.png)
Methyl 1-[(3-cyanophenyl)methyl]piperidine-4-carboxylate
TL;DR: Methyl 1-[(3-cyanophenyl)methyl]piperidine-4-carboxylate (CAS 1016506-74-3) is a chemical compound with molecular formula C15H18N2O2 and molecular weight 258.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-[(3-cyanophenyl)methyl]piperidine-4-carboxylate
Also Known As: Methyl 1-[(3-cyanophenyl)methyl]piperidine-4-carboxylate, Methyl 1-(3-cyanobenzyl)piperidine-4-carboxylate, Methyl1-(3-cyanobenzyl)piperidine-4-carboxylate, A1-49812
| Molecular Formula | C15H18N2O2 |
|---|---|
| Molecular Weight | 258.14 g/mol |
| LogP | 1.94328 |
| Topological Polar Surface Area | 53.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.13684 |
| Heavy Atoms | 19 |
| Complexity | 485.1641 |
Chemical Identifiers
| CAS Number | 1016506-74-3 |
|---|---|
| SMILES | COC(=O)C1CCN(CC1)CC2=CC(=CC=C2)C#N |
Product Overview
Methyl 1-[(3-cyanophenyl)methyl]piperidine-4-carboxylate (CAS 1016506-74-3), with molecular formula C15H18N2O2 and molecular weight 258.14 g/mol. IUPAC: methyl 1-[(3-cyanophenyl)methyl]piperidine-4-carboxylate.
Chemical Property Profile of Methyl 1-[(3-cyanophenyl)methyl]piperidine-4-carboxylate
Property Insights of Methyl 1-[(3-cyanophenyl)methyl]piperidine-4-carboxylate
The XLogP value of 1.94328 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 1-[(3-cyanophenyl)methyl]piperidine-4-carboxylate. With a topological polar surface area (TPSA) of 53.33 Ų, Methyl 1-[(3-cyanophenyl)methyl]piperidine-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 1-[(3-cyanophenyl)methyl]piperidine-4-carboxylate has 0 hydrogen bond donor(s) and 4 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 Methyl 1-[(3-cyanophenyl)methyl]piperidine-4-carboxylate?
The CAS number of Methyl 1-[(3-cyanophenyl)methyl]piperidine-4-carboxylate is 1016506-74-3.
What is the molecular formula of Methyl 1-[(3-cyanophenyl)methyl]piperidine-4-carboxylate?
The molecular formula of Methyl 1-[(3-cyanophenyl)methyl]piperidine-4-carboxylate is C15H18N2O2.
What is the molecular weight of Methyl 1-[(3-cyanophenyl)methyl]piperidine-4-carboxylate?
The molecular weight of Methyl 1-[(3-cyanophenyl)methyl]piperidine-4-carboxylate is 258.14 g/mol.
Where can I buy Methyl 1-[(3-cyanophenyl)methyl]piperidine-4-carboxylate?
You can request a quote for Methyl 1-[(3-cyanophenyl)methyl]piperidine-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 1-[(3-cyanophenyl)methyl]piperidine-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 1-[(3-cyanophenyl)methyl]piperidine-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.