3-fluoro-N-(3-methylbutyl)benzamide
TL;DR: 3-fluoro-N-(3-methylbutyl)benzamide (CAS 64181-37-9) is a chemical compound with molecular formula C12H16FNO and molecular weight 209.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-fluoro-N-(3-methylbutyl)benzamide
Also Known As: 3-fluoro-N-(3-methylbutyl)benzamide, 3-fluoro-N-isopentylbenzamide, Benzamide, 3-fluoro-N-(3-methylbutyl)-, (3-fluorophenyl)-N-(3-methylbutyl)carboxamide, AN-652/41313962
| Molecular Formula | C12H16FNO |
|---|---|
| Molecular Weight | 209.12 g/mol |
| LogP | 2.6016 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 209.1216 |
| Heavy Atoms | 15 |
| Complexity | 336.14893 |
Chemical Identifiers
| CAS Number | 64181-37-9 |
|---|---|
| SMILES | CC(C)CCNC(=O)C1=CC(=CC=C1)F |
Product Overview
3-fluoro-N-(3-methylbutyl)benzamide (CAS 64181-37-9), with molecular formula C12H16FNO and molecular weight 209.12 g/mol. IUPAC: 3-fluoro-N-(3-methylbutyl)benzamide.
Chemical Property Profile of 3-fluoro-N-(3-methylbutyl)benzamide
Property Insights of 3-fluoro-N-(3-methylbutyl)benzamide
The XLogP value of 2.6016 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-fluoro-N-(3-methylbutyl)benzamide. With a topological polar surface area (TPSA) of 29.1 Ų, 3-fluoro-N-(3-methylbutyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-fluoro-N-(3-methylbutyl)benzamide 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 3-fluoro-N-(3-methylbutyl)benzamide?
The CAS number of 3-fluoro-N-(3-methylbutyl)benzamide is 64181-37-9.
What is the molecular formula of 3-fluoro-N-(3-methylbutyl)benzamide?
The molecular formula of 3-fluoro-N-(3-methylbutyl)benzamide is C12H16FNO.
What is the molecular weight of 3-fluoro-N-(3-methylbutyl)benzamide?
The molecular weight of 3-fluoro-N-(3-methylbutyl)benzamide is 209.12 g/mol.
Where can I buy 3-fluoro-N-(3-methylbutyl)benzamide?
You can request a quote for 3-fluoro-N-(3-methylbutyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-fluoro-N-(3-methylbutyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-fluoro-N-(3-methylbutyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.