哌啶-1-甲腈
TL;DR: 哌啶-1-甲腈 (CAS 1530-87-6) is a chemical compound with molecular formula C6H10N2 and molecular weight 110.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
哌啶-1-甲腈
piperidine-1-carbonitrile
Also Known As: 1-Piperidinecarbonitrile, piperidine-1-carbonitrile, 1-Cyanopiperidine, N-cyanopiperidine, Piperidinocarbonitrile
| Molecular Formula | C6H10N2 |
|---|---|
| Molecular Weight | 110.08 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 27.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 110.0844 |
| Heavy Atoms | 8 |
| Complexity | 105.0 |
Chemical Identifiers
| CAS Number | 1530-87-6 |
|---|---|
| SMILES | C1CCN(CC1)C#N |
| InChIKey | NVPICXQHSYQKGM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
哌啶-1-甲腈 (CAS 1530-87-6), with molecular formula C6H10N2 and molecular weight 110.08 g/mol. IUPAC: piperidine-1-carbonitrile.
Chemical Property Profile of 哌啶-1-甲腈
Property Insights of 哌啶-1-甲腈
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 哌啶-1-甲腈. With a topological polar surface area (TPSA) of 27.0 Ų, 哌啶-1-甲腈 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 哌啶-1-甲腈 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 哌啶-1-甲腈?
The CAS number of 哌啶-1-甲腈 is 1530-87-6.
What is the molecular formula of 哌啶-1-甲腈?
The molecular formula of 哌啶-1-甲腈 is C6H10N2.
What is the molecular weight of 哌啶-1-甲腈?
The molecular weight of 哌啶-1-甲腈 is 110.08 g/mol.
Where can I buy 哌啶-1-甲腈?
You can request a quote for 哌啶-1-甲腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 哌啶-1-甲腈?
Yes, KEHONG BIO provides custom synthesis services for 哌啶-1-甲腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.