2-Pyrrolidinone, 1-benzoyl-5-(1-methylethoxy)-, (+-)-
TL;DR: 2-Pyrrolidinone, 1-benzoyl-5-(1-methylethoxy)-, (+-)- (CAS 136410-06-5) is a chemical compound with molecular formula C14H17NO3 and molecular weight 247.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzoyl-5-propan-2-yloxypyrrolidin-2-one
Also Known As: (+-)-1-Benzoyl-5-(1-methylethoxy)-2-pyrrolidinone, 2-Pyrrolidinone, 1-benzoyl-5-(1-methylethoxy)-, (+-)-, 1-benzoyl 5-isopropyloxy pyrrolidin-2-one, 5-Isopropoxy-1-[benzoyl]pyrrolidin-2-one, 1-benzoyl-5-propan-2-yloxypyrrolidin-2-one
| Molecular Formula | C14H17NO3 |
|---|---|
| Molecular Weight | 247.12 g/mol |
| LogP | 2.2003 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 247.12085 |
| Heavy Atoms | 18 |
| Complexity | 441.61215 |
Chemical Identifiers
| CAS Number | 136410-06-5 |
|---|---|
| SMILES | CC(C)OC1CCC(=O)N1C(=O)C2=CC=CC=C2 |
Product Overview
2-Pyrrolidinone, 1-benzoyl-5-(1-methylethoxy)-, (+-)- (CAS 136410-06-5), with molecular formula C14H17NO3 and molecular weight 247.12 g/mol. IUPAC: 1-benzoyl-5-propan-2-yloxypyrrolidin-2-one.
Chemical Property Profile of 2-Pyrrolidinone, 1-benzoyl-5-(1-methylethoxy)-, (+-)-
Property Insights of 2-Pyrrolidinone, 1-benzoyl-5-(1-methylethoxy)-, (+-)-
The XLogP value of 2.2003 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pyrrolidinone, 1-benzoyl-5-(1-methylethoxy)-, (+-)-. With a topological polar surface area (TPSA) of 46.61 Ų, 2-Pyrrolidinone, 1-benzoyl-5-(1-methylethoxy)-, (+-)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyrrolidinone, 1-benzoyl-5-(1-methylethoxy)-, (+-)- 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 2-Pyrrolidinone, 1-benzoyl-5-(1-methylethoxy)-, (+-)-?
The CAS number of 2-Pyrrolidinone, 1-benzoyl-5-(1-methylethoxy)-, (+-)- is 136410-06-5.
What is the molecular formula of 2-Pyrrolidinone, 1-benzoyl-5-(1-methylethoxy)-, (+-)-?
The molecular formula of 2-Pyrrolidinone, 1-benzoyl-5-(1-methylethoxy)-, (+-)- is C14H17NO3.
What is the molecular weight of 2-Pyrrolidinone, 1-benzoyl-5-(1-methylethoxy)-, (+-)-?
The molecular weight of 2-Pyrrolidinone, 1-benzoyl-5-(1-methylethoxy)-, (+-)- is 247.12 g/mol.
Where can I buy 2-Pyrrolidinone, 1-benzoyl-5-(1-methylethoxy)-, (+-)-?
You can request a quote for 2-Pyrrolidinone, 1-benzoyl-5-(1-methylethoxy)-, (+-)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pyrrolidinone, 1-benzoyl-5-(1-methylethoxy)-, (+-)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Pyrrolidinone, 1-benzoyl-5-(1-methylethoxy)-, (+-)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.