N-s-butyl caproamide
TL;DR: N-s-butyl caproamide (CAS 546077-48-9) is a chemical compound with molecular formula C10H21NO and molecular weight 171.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butan-2-ylhexanamide
Also Known As: N-butan-2-ylhexanamide, N-s-butyl caproamide, N-(sec-butyl)hexanamide, N-(butan-2-yl)hexanamide, N-(1-Methylpropyl)hexanamide
| Molecular Formula | C10H21NO |
|---|---|
| Molecular Weight | 171.16 g/mol |
| LogP | 2.4814 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 171.16231 |
| Heavy Atoms | 12 |
| Complexity | 123.00699 |
Chemical Identifiers
| CAS Number | 546077-48-9 |
|---|---|
| SMILES | CCCCCC(=O)NC(C)CC |
Product Overview
N-s-butyl caproamide (CAS 546077-48-9), with molecular formula C10H21NO and molecular weight 171.16 g/mol. IUPAC: N-butan-2-ylhexanamide.
Chemical Property Profile of N-s-butyl caproamide
Property Insights of N-s-butyl caproamide
The XLogP value of 2.4814 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-s-butyl caproamide. With a topological polar surface area (TPSA) of 29.1 Ų, N-s-butyl caproamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-s-butyl caproamide 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-s-butyl caproamide?
The CAS number of N-s-butyl caproamide is 546077-48-9.
What is the molecular formula of N-s-butyl caproamide?
The molecular formula of N-s-butyl caproamide is C10H21NO.
What is the molecular weight of N-s-butyl caproamide?
The molecular weight of N-s-butyl caproamide is 171.16 g/mol.
Where can I buy N-s-butyl caproamide?
You can request a quote for N-s-butyl caproamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-s-butyl caproamide?
Yes, KEHONG BIO provides custom synthesis services for N-s-butyl caproamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.