(3E)-1-Methyl-3-(phenylmethylidene)piperidine hydrochloride
TL;DR: (3E)-1-Methyl-3-(phenylmethylidene)piperidine hydrochloride (CAS 114507-02-7) is a chemical compound with molecular formula C13H18ClN and molecular weight 223.11278 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3E)-3-benzylidene-1-methylpiperidine;hydrochloride
Also Known As: (3E)-1-Methyl-3-(phenylmethylidene)piperidine hydrochloride, (3E)-3-benzylidene-1-methylpiperidine hydrochloride, (3Z)-3-benzylidene-1-methyl-piperidine Hydrochloride, Piperidine, 1-methyl-3-(phenylmethylene)-, hydrochloride, (E)-
Technical Specifications
| Molecular Formula | C13H18ClN |
| Molecular Weight | 223.11278 g/mol |
| XLogP | 3.2174 |
| Topological Polar Surface Area (TPSA) | 3.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 223.11278 Da |
| Heavy Atoms | 15 |
| Complexity | 201.0 |
| SMILES | CN1CCC/C(=C\C2=CC=CC=C2)/C1.Cl |
| InChIKey | LDYDJDVZQJNTPH-RSGUCCNWSA-N |
Chemical Property Profile of (3E)-1-Methyl-3-(phenylmethylidene)piperidine hydrochloride
Property Insights of (3E)-1-Methyl-3-(phenylmethylidene)piperidine hydrochloride
The XLogP value of 3.2174 indicates that (3E)-1-Methyl-3-(phenylmethylidene)piperidine hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, (3E)-1-Methyl-3-(phenylmethylidene)piperidine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3E)-1-Methyl-3-(phenylmethylidene)piperidine hydrochloride has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (3E)-1-Methyl-3-(phenylmethylidene)piperidine hydrochloride?
The CAS number of (3E)-1-Methyl-3-(phenylmethylidene)piperidine hydrochloride is 114507-02-7.
What is the molecular formula of (3E)-1-Methyl-3-(phenylmethylidene)piperidine hydrochloride?
The molecular formula of (3E)-1-Methyl-3-(phenylmethylidene)piperidine hydrochloride is C13H18ClN.
What is the molecular weight of (3E)-1-Methyl-3-(phenylmethylidene)piperidine hydrochloride?
The molecular weight of (3E)-1-Methyl-3-(phenylmethylidene)piperidine hydrochloride is 223.11278 g/mol.
Where can I buy (3E)-1-Methyl-3-(phenylmethylidene)piperidine hydrochloride?
You can request a quote for (3E)-1-Methyl-3-(phenylmethylidene)piperidine hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (3E)-1-Methyl-3-(phenylmethylidene)piperidine hydrochloride?
Yes, CoreyChem provides custom synthesis services for (3E)-1-Methyl-3-(phenylmethylidene)piperidine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.