2-Pyrrolidinone, 5-isopropyl-5-phenyl-
TL;DR: 2-Pyrrolidinone, 5-isopropyl-5-phenyl- (CAS 6139-26-0) is a chemical compound with molecular formula C13H17NO and molecular weight 203.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-phenyl-5-propan-2-ylpyrrolidin-2-one
Also Known As: 5-Isopropyl-5-phenyl-2-pyrrolidinone, 2-Pyrrolidinone, 5-isopropyl-5-phenyl-, 5-phenyl-5-propan-2-ylpyrrolidin-2-one, 2-Phenyl-2-(propan-2-yl)-3,4-dihydro-2H-pyrrol-5-ol, RefChem:1064797
| Molecular Formula | C13H17NO |
|---|---|
| Molecular Weight | 203.13 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 203.13101 |
| Heavy Atoms | 15 |
| Complexity | 243.0 |
Chemical Identifiers
| CAS Number | 6139-26-0 |
|---|---|
| SMILES | CC(C)C1(CCC(=O)N1)C2=CC=CC=C2 |
| InChIKey | ZYFALOITZCONJI-UHFFFAOYSA-N |
Product Overview
2-Pyrrolidinone, 5-isopropyl-5-phenyl- (CAS 6139-26-0), with molecular formula C13H17NO and molecular weight 203.13 g/mol. IUPAC: 5-phenyl-5-propan-2-ylpyrrolidin-2-one.
Chemical Property Profile of 2-Pyrrolidinone, 5-isopropyl-5-phenyl-
Property Insights of 2-Pyrrolidinone, 5-isopropyl-5-phenyl-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pyrrolidinone, 5-isopropyl-5-phenyl-. With a topological polar surface area (TPSA) of 29.1 Ų, 2-Pyrrolidinone, 5-isopropyl-5-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyrrolidinone, 5-isopropyl-5-phenyl- 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 2-Pyrrolidinone, 5-isopropyl-5-phenyl-?
The CAS number of 2-Pyrrolidinone, 5-isopropyl-5-phenyl- is 6139-26-0.
What is the molecular formula of 2-Pyrrolidinone, 5-isopropyl-5-phenyl-?
The molecular formula of 2-Pyrrolidinone, 5-isopropyl-5-phenyl- is C13H17NO.
What is the molecular weight of 2-Pyrrolidinone, 5-isopropyl-5-phenyl-?
The molecular weight of 2-Pyrrolidinone, 5-isopropyl-5-phenyl- is 203.13 g/mol.
Where can I buy 2-Pyrrolidinone, 5-isopropyl-5-phenyl-?
You can request a quote for 2-Pyrrolidinone, 5-isopropyl-5-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pyrrolidinone, 5-isopropyl-5-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Pyrrolidinone, 5-isopropyl-5-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.