2-Propylisonicotinonitrile
TL;DR: 2-Propylisonicotinonitrile (CAS 33744-19-3) is a chemical compound with molecular formula C9H10N2 and molecular weight 146.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-propylpyridine-4-carbonitrile
Also Known As: 2-Propylisonicotinonitrile, 2-propylpyridine-4-carbonitrile, 2-Propyl-4-pyridinecarbonitrile, 2-propyl-isonicotinonitrile, 4-Pyridinecarbonitrile, 2-propyl-
| Molecular Formula | C9H10N2 |
|---|---|
| Molecular Weight | 146.08 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 36.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 146.0844 |
| Heavy Atoms | 11 |
| Complexity | 156.0 |
Chemical Identifiers
| CAS Number | 33744-19-3 |
|---|---|
| SMILES | CCCC1=NC=CC(=C1)C#N |
| InChIKey | BYKWSKWKQONOOH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Propylisonicotinonitrile (CAS 33744-19-3), with molecular formula C9H10N2 and molecular weight 146.08 g/mol. IUPAC: 2-propylpyridine-4-carbonitrile.
Chemical Property Profile of 2-Propylisonicotinonitrile
Property Insights of 2-Propylisonicotinonitrile
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propylisonicotinonitrile. With a topological polar surface area (TPSA) of 36.7 Ų, 2-Propylisonicotinonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propylisonicotinonitrile 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 2-Propylisonicotinonitrile?
The CAS number of 2-Propylisonicotinonitrile is 33744-19-3.
What is the molecular formula of 2-Propylisonicotinonitrile?
The molecular formula of 2-Propylisonicotinonitrile is C9H10N2.
What is the molecular weight of 2-Propylisonicotinonitrile?
The molecular weight of 2-Propylisonicotinonitrile is 146.08 g/mol.
Where can I buy 2-Propylisonicotinonitrile?
You can request a quote for 2-Propylisonicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propylisonicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Propylisonicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.