4-tert-butyl-N-pentylbenzamide
TL;DR: 4-tert-butyl-N-pentylbenzamide (CAS 101927-52-0) is a chemical compound with molecular formula C16H25NO and molecular weight 247.19362 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-tert-butyl-N-pentylbenzamide
Also Known As: 4-tert-butyl-N-pentylbenzamide, N-pentyl-4-tert-butyl-benzamide, 4-(1,1-Dimethylethyl)-N-pentylbenzamide
Technical Specifications
| Molecular Formula | C16H25NO |
| Molecular Weight | 247.19362 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 247.19362 Da |
| Heavy Atoms | 18 |
| Complexity | 246.0 |
| SMILES | CCCCCNC(=O)C1=CC=C(C=C1)C(C)(C)C |
| InChIKey | FFDHBPVAZUFEHF-UHFFFAOYSA-N |
Chemical Property Profile of 4-tert-butyl-N-pentylbenzamide
Property Insights of 4-tert-butyl-N-pentylbenzamide
The XLogP value of 4.6 indicates that 4-tert-butyl-N-pentylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 4-tert-butyl-N-pentylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-tert-butyl-N-pentylbenzamide 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
What is the CAS number of 4-tert-butyl-N-pentylbenzamide?
The CAS number of 4-tert-butyl-N-pentylbenzamide is 101927-52-0.
What is the molecular formula of 4-tert-butyl-N-pentylbenzamide?
The molecular formula of 4-tert-butyl-N-pentylbenzamide is C16H25NO.
What is the molecular weight of 4-tert-butyl-N-pentylbenzamide?
The molecular weight of 4-tert-butyl-N-pentylbenzamide is 247.19362 g/mol.
Where can I buy 4-tert-butyl-N-pentylbenzamide?
You can request a quote for 4-tert-butyl-N-pentylbenzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-tert-butyl-N-pentylbenzamide?
Yes, CoreyChem provides custom synthesis services for 4-tert-butyl-N-pentylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.