2',5'-Dimethyloctananilide
TL;DR: 2',5'-Dimethyloctananilide (CAS 121990-02-1) is a chemical compound with molecular formula C16H25NO and molecular weight 247.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,5-dimethylphenyl)octanamide
Also Known As: N-(2,5-dimethylphenyl)octanamide, 2',5'-DIMETHYLOCTANANILIDE, 662-660-1, RefChem:439478
| Molecular Formula | C16H25NO |
|---|---|
| Molecular Weight | 247.19 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 247.19362 |
| Heavy Atoms | 18 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 121990-02-1 |
|---|---|
| SMILES | CCCCCCCC(=O)NC1=C(C=CC(=C1)C)C |
| InChIKey | WGHCRXJXYPIUNA-UHFFFAOYSA-N |
Product Overview
2',5'-Dimethyloctananilide (CAS 121990-02-1), with molecular formula C16H25NO and molecular weight 247.19 g/mol. IUPAC: N-(2,5-dimethylphenyl)octanamide.
Chemical Property Profile of 2',5'-Dimethyloctananilide
Property Insights of 2',5'-Dimethyloctananilide
The XLogP value of 4.5 indicates that 2',5'-Dimethyloctananilide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 2',5'-Dimethyloctananilide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2',5'-Dimethyloctananilide has 1 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 2',5'-Dimethyloctananilide?
The CAS number of 2',5'-Dimethyloctananilide is 121990-02-1.
What is the molecular formula of 2',5'-Dimethyloctananilide?
The molecular formula of 2',5'-Dimethyloctananilide is C16H25NO.
What is the molecular weight of 2',5'-Dimethyloctananilide?
The molecular weight of 2',5'-Dimethyloctananilide is 247.19 g/mol.
Where can I buy 2',5'-Dimethyloctananilide?
You can request a quote for 2',5'-Dimethyloctananilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2',5'-Dimethyloctananilide?
Yes, KEHONG BIO provides custom synthesis services for 2',5'-Dimethyloctananilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.