Piperidine-1-valeronitrile
TL;DR: Piperidine-1-valeronitrile (CAS 4734-49-0) is a chemical compound with molecular formula C10H18N2 and molecular weight 166.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-piperidin-1-ylpentanenitrile
Also Known As: Piperidine-1-valeronitrile, 1-Piperidinepentanenitrile, 5-piperidinovaleronitrile, Piperidinepentanenitrile, 5-piperidin-1-ylpentanenitrile
| Molecular Formula | C10H18N2 |
|---|---|
| Molecular Weight | 166.15 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 27.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 166.147 |
| Heavy Atoms | 12 |
| Complexity | 150.0 |
Chemical Identifiers
| CAS Number | 4734-49-0 |
|---|---|
| SMILES | C1CCN(CC1)CCCCC#N |
| InChIKey | FDSRLFIEZWQEEU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Piperidine-1-valeronitrile (CAS 4734-49-0), with molecular formula C10H18N2 and molecular weight 166.15 g/mol. IUPAC: 5-piperidin-1-ylpentanenitrile.
Chemical Property Profile of Piperidine-1-valeronitrile
Property Insights of Piperidine-1-valeronitrile
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperidine-1-valeronitrile. With a topological polar surface area (TPSA) of 27.0 Ų, Piperidine-1-valeronitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperidine-1-valeronitrile 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 Piperidine-1-valeronitrile?
The CAS number of Piperidine-1-valeronitrile is 4734-49-0.
What is the molecular formula of Piperidine-1-valeronitrile?
The molecular formula of Piperidine-1-valeronitrile is C10H18N2.
What is the molecular weight of Piperidine-1-valeronitrile?
The molecular weight of Piperidine-1-valeronitrile is 166.15 g/mol.
Where can I buy Piperidine-1-valeronitrile?
You can request a quote for Piperidine-1-valeronitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperidine-1-valeronitrile?
Yes, KEHONG BIO provides custom synthesis services for Piperidine-1-valeronitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.