trans-1,3,5-Trimethylpiperidine
TL;DR: trans-1,3,5-Trimethylpiperidine (CAS 16544-52-8) is a chemical compound with molecular formula C8H17N and molecular weight 127.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,5R)-1,3,5-trimethylpiperidine
Also Known As: Coppellidin [German], trans-1,3,5-Trimethylpiperidine, (3R,5R)-1,3,5-trimethylpiperidine, (3R,5S)-1,3,5-trimethylpiperidine, (3R,5R)-Rel-1,3,5-Trimethylpiperidine
| Molecular Formula | C8H17N |
|---|---|
| Molecular Weight | 127.14 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 127.1361 |
| Heavy Atoms | 9 |
| Complexity | 80.0 |
Chemical Identifiers
| CAS Number | 16544-52-8 |
|---|---|
| SMILES | C[C@@H]1C[C@H](CN(C1)C)C |
| InChIKey | IGJDIGJIINCEDE-HTQZYQBOSA-N |
Product Overview
trans-1,3,5-Trimethylpiperidine (CAS 16544-52-8), with molecular formula C8H17N and molecular weight 127.14 g/mol. IUPAC: (3R,5R)-1,3,5-trimethylpiperidine.
Chemical Property Profile of trans-1,3,5-Trimethylpiperidine
Property Insights of trans-1,3,5-Trimethylpiperidine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for trans-1,3,5-Trimethylpiperidine. With a topological polar surface area (TPSA) of 3.2 Ų, trans-1,3,5-Trimethylpiperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trans-1,3,5-Trimethylpiperidine has 0 hydrogen bond donor(s) and 1 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 trans-1,3,5-Trimethylpiperidine?
The CAS number of trans-1,3,5-Trimethylpiperidine is 16544-52-8.
What is the molecular formula of trans-1,3,5-Trimethylpiperidine?
The molecular formula of trans-1,3,5-Trimethylpiperidine is C8H17N.
What is the molecular weight of trans-1,3,5-Trimethylpiperidine?
The molecular weight of trans-1,3,5-Trimethylpiperidine is 127.14 g/mol.
Where can I buy trans-1,3,5-Trimethylpiperidine?
You can request a quote for trans-1,3,5-Trimethylpiperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for trans-1,3,5-Trimethylpiperidine?
Yes, KEHONG BIO provides custom synthesis services for trans-1,3,5-Trimethylpiperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.