Ethyl 5-(dipropan-2-ylamino)-5-oxopentanoate
TL;DR: Ethyl 5-(dipropan-2-ylamino)-5-oxopentanoate (CAS 84375-71-3) is a chemical compound with molecular formula C13H25NO3 and molecular weight 243.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[di(propan-2-yl)amino]-5-oxopentanoate
Also Known As: 3-methylbutyl 2-hydroxyoctanoate, ethyl 5-(dipropan-2-ylamino)-5-oxopentanoate, ethyl 5-[di(propan-2-yl)amino]-5-oxopentanoate, Pentanoic acid,5-[bis(1-methylethyl)amino]-5-oxo-, ethyl ester
| Molecular Formula | C13H25NO3 |
|---|---|
| Molecular Weight | 243.18 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 243.18344 |
| Heavy Atoms | 17 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 84375-71-3 |
|---|---|
| SMILES | CCOC(=O)CCCC(=O)N(C(C)C)C(C)C |
| InChIKey | VGAJVYHZZNGSKR-UHFFFAOYSA-N |
Product Overview
Ethyl 5-(dipropan-2-ylamino)-5-oxopentanoate (CAS 84375-71-3), with molecular formula C13H25NO3 and molecular weight 243.18 g/mol. IUPAC: ethyl 5-[di(propan-2-yl)amino]-5-oxopentanoate.
Chemical Property Profile of Ethyl 5-(dipropan-2-ylamino)-5-oxopentanoate
Property Insights of Ethyl 5-(dipropan-2-ylamino)-5-oxopentanoate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 5-(dipropan-2-ylamino)-5-oxopentanoate. With a topological polar surface area (TPSA) of 46.6 Ų, Ethyl 5-(dipropan-2-ylamino)-5-oxopentanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 5-(dipropan-2-ylamino)-5-oxopentanoate has 0 hydrogen bond donor(s) and 3 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 Ethyl 5-(dipropan-2-ylamino)-5-oxopentanoate?
The CAS number of Ethyl 5-(dipropan-2-ylamino)-5-oxopentanoate is 84375-71-3.
What is the molecular formula of Ethyl 5-(dipropan-2-ylamino)-5-oxopentanoate?
The molecular formula of Ethyl 5-(dipropan-2-ylamino)-5-oxopentanoate is C13H25NO3.
What is the molecular weight of Ethyl 5-(dipropan-2-ylamino)-5-oxopentanoate?
The molecular weight of Ethyl 5-(dipropan-2-ylamino)-5-oxopentanoate is 243.18 g/mol.
Where can I buy Ethyl 5-(dipropan-2-ylamino)-5-oxopentanoate?
You can request a quote for Ethyl 5-(dipropan-2-ylamino)-5-oxopentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 5-(dipropan-2-ylamino)-5-oxopentanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 5-(dipropan-2-ylamino)-5-oxopentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.