N-(butan-2-yl)-3-fluorobenzamide
TL;DR: N-(butan-2-yl)-3-fluorobenzamide (CAS 64181-36-8) is a chemical compound with molecular formula C11H14FNO and molecular weight 195.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butan-2-yl-3-fluorobenzamide
Also Known As: N-(butan-2-yl)-3-fluorobenzamide, N-butan-2-yl-3-fluorobenzamide, N-(sec-butyl)-3-fluorobenzamide, N-butan-2-yl-3-fluoro-benzamide
| Molecular Formula | C11H14FNO |
|---|---|
| Molecular Weight | 195.11 g/mol |
| LogP | 2.354 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 195.10594 |
| Heavy Atoms | 14 |
| Complexity | 324.8185 |
Chemical Identifiers
| CAS Number | 64181-36-8 |
|---|---|
| SMILES | CCC(C)NC(=O)C1=CC(=CC=C1)F |
Product Overview
N-(butan-2-yl)-3-fluorobenzamide (CAS 64181-36-8), with molecular formula C11H14FNO and molecular weight 195.11 g/mol. IUPAC: N-butan-2-yl-3-fluorobenzamide.
Chemical Property Profile of N-(butan-2-yl)-3-fluorobenzamide
Property Insights of N-(butan-2-yl)-3-fluorobenzamide
The XLogP value of 2.354 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(butan-2-yl)-3-fluorobenzamide. With a topological polar surface area (TPSA) of 29.1 Ų, N-(butan-2-yl)-3-fluorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(butan-2-yl)-3-fluorobenzamide 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 N-(butan-2-yl)-3-fluorobenzamide?
The CAS number of N-(butan-2-yl)-3-fluorobenzamide is 64181-36-8.
What is the molecular formula of N-(butan-2-yl)-3-fluorobenzamide?
The molecular formula of N-(butan-2-yl)-3-fluorobenzamide is C11H14FNO.
What is the molecular weight of N-(butan-2-yl)-3-fluorobenzamide?
The molecular weight of N-(butan-2-yl)-3-fluorobenzamide is 195.11 g/mol.
Where can I buy N-(butan-2-yl)-3-fluorobenzamide?
You can request a quote for N-(butan-2-yl)-3-fluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(butan-2-yl)-3-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(butan-2-yl)-3-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.