3-Methyl-1-(2-phenylethyl)piperidin-4-one
TL;DR: 3-Methyl-1-(2-phenylethyl)piperidin-4-one (CAS 83208-25-7) is a chemical compound with molecular formula C14H19NO and molecular weight 217.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-1-(2-phenylethyl)piperidin-4-one
Also Known As: 3-methyl-1-phenethylpiperidin-4-one, 3-methyl-1-(2-phenylethyl)piperidin-4-one, 1-Phenethyl-3-methyl-4-piperidone, 4-piperidinone, 3-methyl-1-(2-phenylethyl)-, 3-Methyl-1-(2-Phenylethyl)-4-Piperidone
| Molecular Formula | C14H19NO |
|---|---|
| Molecular Weight | 217.15 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 217.14667 |
| Heavy Atoms | 16 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 83208-25-7 |
|---|---|
| SMILES | CC1CN(CCC1=O)CCC2=CC=CC=C2 |
| InChIKey | FYNKVRCSKRJSSF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methyl-1-(2-phenylethyl)piperidin-4-one (CAS 83208-25-7), with molecular formula C14H19NO and molecular weight 217.15 g/mol. IUPAC: 3-methyl-1-(2-phenylethyl)piperidin-4-one.
Chemical Property Profile of 3-Methyl-1-(2-phenylethyl)piperidin-4-one
Property Insights of 3-Methyl-1-(2-phenylethyl)piperidin-4-one
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-1-(2-phenylethyl)piperidin-4-one. With a topological polar surface area (TPSA) of 20.3 Ų, 3-Methyl-1-(2-phenylethyl)piperidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-1-(2-phenylethyl)piperidin-4-one has 0 hydrogen bond donor(s) and 2 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 3-Methyl-1-(2-phenylethyl)piperidin-4-one?
The CAS number of 3-Methyl-1-(2-phenylethyl)piperidin-4-one is 83208-25-7.
What is the molecular formula of 3-Methyl-1-(2-phenylethyl)piperidin-4-one?
The molecular formula of 3-Methyl-1-(2-phenylethyl)piperidin-4-one is C14H19NO.
What is the molecular weight of 3-Methyl-1-(2-phenylethyl)piperidin-4-one?
The molecular weight of 3-Methyl-1-(2-phenylethyl)piperidin-4-one is 217.15 g/mol.
Where can I buy 3-Methyl-1-(2-phenylethyl)piperidin-4-one?
You can request a quote for 3-Methyl-1-(2-phenylethyl)piperidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-1-(2-phenylethyl)piperidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-1-(2-phenylethyl)piperidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.