1-Piperidinocyclohexanecarbonitrile
TL;DR: 1-Piperidinocyclohexanecarbonitrile (CAS 3867-15-0) is a chemical compound with molecular formula C12H20N2 and molecular weight 192.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-piperidin-1-ylcyclohexane-1-carbonitrile
Also Known As: 1-PIPERIDINOCYCLOHEXANECARBONITRILE, 1-(1-Cyanocyclohexyl)piperidine, Piperidinocyclohexanecarbonitrile, 1-(piperidin-1-yl)cyclohexane-1-carbonitrile, Cyclohexanecarbonitrile, 1-(1-piperidinyl)-
| Molecular Formula | C12H20N2 |
|---|---|
| Molecular Weight | 192.16 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 27.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 192.16264 |
| Heavy Atoms | 14 |
| Complexity | 226.0 |
Chemical Identifiers
| CAS Number | 3867-15-0 |
|---|---|
| SMILES | C1CCC(CC1)(C#N)N2CCCCC2 |
| InChIKey | WWSAYKJWUZJLRT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Piperidinocyclohexanecarbonitrile (CAS 3867-15-0), with molecular formula C12H20N2 and molecular weight 192.16 g/mol. IUPAC: 1-piperidin-1-ylcyclohexane-1-carbonitrile.
Chemical Property Profile of 1-Piperidinocyclohexanecarbonitrile
Property Insights of 1-Piperidinocyclohexanecarbonitrile
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Piperidinocyclohexanecarbonitrile. With a topological polar surface area (TPSA) of 27.0 Ų, 1-Piperidinocyclohexanecarbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Piperidinocyclohexanecarbonitrile has 0 hydrogen bond donor(s) and 2 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-Piperidinocyclohexanecarbonitrile?
The CAS number of 1-Piperidinocyclohexanecarbonitrile is 3867-15-0.
What is the molecular formula of 1-Piperidinocyclohexanecarbonitrile?
The molecular formula of 1-Piperidinocyclohexanecarbonitrile is C12H20N2.
What is the molecular weight of 1-Piperidinocyclohexanecarbonitrile?
The molecular weight of 1-Piperidinocyclohexanecarbonitrile is 192.16 g/mol.
Where can I buy 1-Piperidinocyclohexanecarbonitrile?
You can request a quote for 1-Piperidinocyclohexanecarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Piperidinocyclohexanecarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 1-Piperidinocyclohexanecarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.