1-Piperidino-1-isobutene
TL;DR: 1-Piperidino-1-isobutene (CAS 673-33-6) is a chemical compound with molecular formula CC(=CN1CCCCC1)C and molecular weight 139.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-methylprop-1-enyl)piperidine
Also Known As: 1-Piperidinoisobutene, Piperidino-isobuten, Piperidine, 1-(2-methyl-1-propenyl)-, 1-Piperidino-1-isobutene, N-Isobutenylpiperidine
| Molecular Formula | CC(=CN1CCCCC1)C |
|---|---|
| Molecular Weight | 139.14 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 139.1361 |
| Heavy Atoms | 10 |
| Complexity | 117.0 |
Chemical Identifiers
| CAS Number | 673-33-6 |
|---|---|
| SMILES | CC(=CN1CCCCC1)C |
| InChIKey | ZQZUJFQBFGFJMM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Piperidino-1-isobutene (CAS 673-33-6), with molecular formula CC(=CN1CCCCC1)C and molecular weight 139.14 g/mol. IUPAC: 1-(2-methylprop-1-enyl)piperidine.
Chemical Property Profile of 1-Piperidino-1-isobutene
Property Insights of 1-Piperidino-1-isobutene
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Piperidino-1-isobutene. With a topological polar surface area (TPSA) of 3.2 Ų, 1-Piperidino-1-isobutene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Piperidino-1-isobutene 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 1-Piperidino-1-isobutene?
The CAS number of 1-Piperidino-1-isobutene is 673-33-6.
What is the molecular formula of 1-Piperidino-1-isobutene?
The molecular formula of 1-Piperidino-1-isobutene is CC(=CN1CCCCC1)C.
What is the molecular weight of 1-Piperidino-1-isobutene?
The molecular weight of 1-Piperidino-1-isobutene is 139.14 g/mol.
Where can I buy 1-Piperidino-1-isobutene?
You can request a quote for 1-Piperidino-1-isobutene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Piperidino-1-isobutene?
Yes, KEHONG BIO provides custom synthesis services for 1-Piperidino-1-isobutene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.