2-Pyrrolidinone, 3,3-dimethyl-5-((4-methylphenyl)methyl)-
TL;DR: 2-Pyrrolidinone, 3,3-dimethyl-5-((4-methylphenyl)methyl)- (CAS 97562-02-2) is a chemical compound with molecular formula C14H19NO and molecular weight 217.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-5-[(4-methylphenyl)methyl]pyrrolidin-2-one
Also Known As: SR 42003, 3,3-Dimethyl-5-((4-methylphenyl)methyl)-2-pyrrolidinone, 2-Pyrrolidinone, 3,3-dimethyl-5-((4-methylphenyl)methyl)-, 3,3-dimethyl-5-[(4-methylphenyl)methyl]pyrrolidin-2-one, 4,4-Dimethyl-2-[(4-methylphenyl)methyl]-3,4-dihydro-2H-pyrrol-5-ol
| Molecular Formula | C14H19NO |
|---|---|
| Molecular Weight | 217.15 g/mol |
| LogP | 2.45222 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.14667 |
| Heavy Atoms | 16 |
| Complexity | 391.7013 |
Chemical Identifiers
| CAS Number | 97562-02-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CC2CC(C(=O)N2)(C)C |
Product Overview
2-Pyrrolidinone, 3,3-dimethyl-5-((4-methylphenyl)methyl)- (CAS 97562-02-2), with molecular formula C14H19NO and molecular weight 217.15 g/mol. IUPAC: 3,3-dimethyl-5-[(4-methylphenyl)methyl]pyrrolidin-2-one.
Chemical Property Profile of 2-Pyrrolidinone, 3,3-dimethyl-5-((4-methylphenyl)methyl)-
Property Insights of 2-Pyrrolidinone, 3,3-dimethyl-5-((4-methylphenyl)methyl)-
The XLogP value of 2.45222 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pyrrolidinone, 3,3-dimethyl-5-((4-methylphenyl)methyl)-. With a topological polar surface area (TPSA) of 29.1 Ų, 2-Pyrrolidinone, 3,3-dimethyl-5-((4-methylphenyl)methyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyrrolidinone, 3,3-dimethyl-5-((4-methylphenyl)methyl)- 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, 3,3-dimethyl-5-((4-methylphenyl)methyl)-?
The CAS number of 2-Pyrrolidinone, 3,3-dimethyl-5-((4-methylphenyl)methyl)- is 97562-02-2.
What is the molecular formula of 2-Pyrrolidinone, 3,3-dimethyl-5-((4-methylphenyl)methyl)-?
The molecular formula of 2-Pyrrolidinone, 3,3-dimethyl-5-((4-methylphenyl)methyl)- is C14H19NO.
What is the molecular weight of 2-Pyrrolidinone, 3,3-dimethyl-5-((4-methylphenyl)methyl)-?
The molecular weight of 2-Pyrrolidinone, 3,3-dimethyl-5-((4-methylphenyl)methyl)- is 217.15 g/mol.
Where can I buy 2-Pyrrolidinone, 3,3-dimethyl-5-((4-methylphenyl)methyl)-?
You can request a quote for 2-Pyrrolidinone, 3,3-dimethyl-5-((4-methylphenyl)methyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pyrrolidinone, 3,3-dimethyl-5-((4-methylphenyl)methyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Pyrrolidinone, 3,3-dimethyl-5-((4-methylphenyl)methyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.