4,4-Dimethylpiperidine
TL;DR: 4,4-Dimethylpiperidine (CAS 4045-30-1) is a chemical compound with molecular formula C7H15N and molecular weight 113.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-dimethylpiperidine
Also Known As: 4,4-Dimethylpiperidine, Piperidine, 4,4-dimethyl-, 4,4-dimethyl-piperidine, 4,4-dimethyl piperidine, Piperidine,4,4-dimethyl
| Molecular Formula | C7H15N |
|---|---|
| Molecular Weight | 113.12 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 113.12045 |
| Heavy Atoms | 8 |
| Complexity | 68.0 |
Chemical Identifiers
| CAS Number | 4045-30-1 |
|---|---|
| SMILES | CC1(CCNCC1)C |
| InChIKey | IECMOFZIMWVOAS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,4-Dimethylpiperidine (CAS 4045-30-1), with molecular formula C7H15N and molecular weight 113.12 g/mol. IUPAC: 4,4-dimethylpiperidine.
Chemical Property Profile of 4,4-Dimethylpiperidine
Property Insights of 4,4-Dimethylpiperidine
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4-Dimethylpiperidine. With a topological polar surface area (TPSA) of 12.0 Ų, 4,4-Dimethylpiperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4-Dimethylpiperidine 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
Frequently Asked Questions
What is the CAS number of 4,4-Dimethylpiperidine?
The CAS number of 4,4-Dimethylpiperidine is 4045-30-1.
What is the molecular formula of 4,4-Dimethylpiperidine?
The molecular formula of 4,4-Dimethylpiperidine is C7H15N.
What is the molecular weight of 4,4-Dimethylpiperidine?
The molecular weight of 4,4-Dimethylpiperidine is 113.12 g/mol.
Where can I buy 4,4-Dimethylpiperidine?
You can request a quote for 4,4-Dimethylpiperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4-Dimethylpiperidine?
Yes, KEHONG BIO provides custom synthesis services for 4,4-Dimethylpiperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.