N-Ethyl-2,2-diisopropylbutanamide
TL;DR: N-Ethyl-2,2-diisopropylbutanamide (CAS 51115-70-9) is a chemical compound with molecular formula C12H25NO and molecular weight 199.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,2-diethyl-3-methyl-2-propan-2-ylbutanamide
Also Known As: n-ethyl-2,2-diisopropylbutanamide, N,2-Diethyl-2-(isopropyl)-3-methylbutyramide, Cooling agent WS-27, EINECS 256-978-6, FEMA NO. 4557
| Molecular Formula | C12H25NO |
|---|---|
| Molecular Weight | 199.19 g/mol |
| LogP | 2.8309 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 199.19362 |
| Heavy Atoms | 14 |
| Complexity | 176.76076 |
Chemical Identifiers
| CAS Number | 51115-70-9 |
|---|---|
| SMILES | CCC(C(C)C)(C(C)C)C(=O)NCC |
Product Overview
N-Ethyl-2,2-diisopropylbutanamide (CAS 51115-70-9), with molecular formula C12H25NO and molecular weight 199.19 g/mol. IUPAC: N,2-diethyl-3-methyl-2-propan-2-ylbutanamide.
Chemical Property Profile of N-Ethyl-2,2-diisopropylbutanamide
Property Insights of N-Ethyl-2,2-diisopropylbutanamide
The XLogP value of 2.8309 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Ethyl-2,2-diisopropylbutanamide. With a topological polar surface area (TPSA) of 29.1 Ų, N-Ethyl-2,2-diisopropylbutanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Ethyl-2,2-diisopropylbutanamide 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-Ethyl-2,2-diisopropylbutanamide?
The CAS number of N-Ethyl-2,2-diisopropylbutanamide is 51115-70-9.
What is the molecular formula of N-Ethyl-2,2-diisopropylbutanamide?
The molecular formula of N-Ethyl-2,2-diisopropylbutanamide is C12H25NO.
What is the molecular weight of N-Ethyl-2,2-diisopropylbutanamide?
The molecular weight of N-Ethyl-2,2-diisopropylbutanamide is 199.19 g/mol.
Where can I buy N-Ethyl-2,2-diisopropylbutanamide?
You can request a quote for N-Ethyl-2,2-diisopropylbutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Ethyl-2,2-diisopropylbutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-Ethyl-2,2-diisopropylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.