4-Hydroxy-1,3,5-trimethyl-2-phenylpiperidine-4-carbonitrile
TL;DR: 4-Hydroxy-1,3,5-trimethyl-2-phenylpiperidine-4-carbonitrile (CAS 161894-29-7) is a chemical compound with molecular formula C15H20N2O and molecular weight 244.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-1,3,5-trimethyl-2-phenylpiperidine-4-carbonitrile
Also Known As: 4-hydroxy-1,3,5-trimethyl-2-phenylpiperidine-4-carbonitrile, 4-Hydroxy-1,3,5-trimethyl-2-phenyl-4-piperidinecarbonitrile, 4-Hydroxy-1,3,5-trimethyl-2-phenyl-4-piperidinecarbonitrile #, 4-Cyano-4-hydroxy-2-phenyl-1,3,5-trimethylpiperidine(2.alpha., 3.beta., 4.alpha., 5.beta.)-
| Molecular Formula | C15H20N2O |
|---|---|
| Molecular Weight | 244.16 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 47.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 244.15756 |
| Heavy Atoms | 18 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 161894-29-7 |
|---|---|
| SMILES | CC1CN(C(C(C1(C#N)O)C)C2=CC=CC=C2)C |
| InChIKey | YYWGOFGEYIAJJS-UHFFFAOYSA-N |
Product Overview
4-Hydroxy-1,3,5-trimethyl-2-phenylpiperidine-4-carbonitrile (CAS 161894-29-7), with molecular formula C15H20N2O and molecular weight 244.16 g/mol. IUPAC: 4-hydroxy-1,3,5-trimethyl-2-phenylpiperidine-4-carbonitrile.
Chemical Property Profile of 4-Hydroxy-1,3,5-trimethyl-2-phenylpiperidine-4-carbonitrile
Property Insights of 4-Hydroxy-1,3,5-trimethyl-2-phenylpiperidine-4-carbonitrile
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Hydroxy-1,3,5-trimethyl-2-phenylpiperidine-4-carbonitrile. With a topological polar surface area (TPSA) of 47.3 Ų, 4-Hydroxy-1,3,5-trimethyl-2-phenylpiperidine-4-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Hydroxy-1,3,5-trimethyl-2-phenylpiperidine-4-carbonitrile 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
Frequently Asked Questions
What is the CAS number of 4-Hydroxy-1,3,5-trimethyl-2-phenylpiperidine-4-carbonitrile?
The CAS number of 4-Hydroxy-1,3,5-trimethyl-2-phenylpiperidine-4-carbonitrile is 161894-29-7.
What is the molecular formula of 4-Hydroxy-1,3,5-trimethyl-2-phenylpiperidine-4-carbonitrile?
The molecular formula of 4-Hydroxy-1,3,5-trimethyl-2-phenylpiperidine-4-carbonitrile is C15H20N2O.
What is the molecular weight of 4-Hydroxy-1,3,5-trimethyl-2-phenylpiperidine-4-carbonitrile?
The molecular weight of 4-Hydroxy-1,3,5-trimethyl-2-phenylpiperidine-4-carbonitrile is 244.16 g/mol.
Where can I buy 4-Hydroxy-1,3,5-trimethyl-2-phenylpiperidine-4-carbonitrile?
You can request a quote for 4-Hydroxy-1,3,5-trimethyl-2-phenylpiperidine-4-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hydroxy-1,3,5-trimethyl-2-phenylpiperidine-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxy-1,3,5-trimethyl-2-phenylpiperidine-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.