![3-[4-(2-Methylpropyl)phenyl]-1-pyrrolidin-1-ylprop-2-en-1-one structure](/static/products/3290/329059-03-2.webp)
3-[4-(2-Methylpropyl)phenyl]-1-pyrrolidin-1-ylprop-2-en-1-one
TL;DR: 3-[4-(2-Methylpropyl)phenyl]-1-pyrrolidin-1-ylprop-2-en-1-one (CAS 329059-03-2) is a chemical compound with molecular formula C17H23NO and molecular weight 257.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(2-methylpropyl)phenyl]-1-pyrrolidin-1-ylprop-2-en-1-one
Also Known As: TimTec1_000789, (E)-3-(4-isobutylphenyl)-1-(1-pyrrolidinyl)-2-propen-1-one, 3-[4-(2-methylpropyl)phenyl]-1-pyrrolidin-1-ylprop-2-en-1-one
| Molecular Formula | C17H23NO |
|---|---|
| Molecular Weight | 257.18 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 257.17798 |
| Heavy Atoms | 19 |
| Complexity | 307.0 |
Chemical Identifiers
| CAS Number | 329059-03-2 |
|---|---|
| SMILES | CC(C)CC1=CC=C(C=C1)C=CC(=O)N2CCCC2 |
| InChIKey | PTXGTICIJKJDCX-UHFFFAOYSA-N |
Product Overview
3-[4-(2-Methylpropyl)phenyl]-1-pyrrolidin-1-ylprop-2-en-1-one (CAS 329059-03-2), with molecular formula C17H23NO and molecular weight 257.18 g/mol. IUPAC: 3-[4-(2-methylpropyl)phenyl]-1-pyrrolidin-1-ylprop-2-en-1-one.
Chemical Property Profile of 3-[4-(2-Methylpropyl)phenyl]-1-pyrrolidin-1-ylprop-2-en-1-one
Property Insights of 3-[4-(2-Methylpropyl)phenyl]-1-pyrrolidin-1-ylprop-2-en-1-one
The XLogP value of 4.0 indicates that 3-[4-(2-Methylpropyl)phenyl]-1-pyrrolidin-1-ylprop-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 3-[4-(2-Methylpropyl)phenyl]-1-pyrrolidin-1-ylprop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[4-(2-Methylpropyl)phenyl]-1-pyrrolidin-1-ylprop-2-en-1-one has 0 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 3-[4-(2-Methylpropyl)phenyl]-1-pyrrolidin-1-ylprop-2-en-1-one?
The CAS number of 3-[4-(2-Methylpropyl)phenyl]-1-pyrrolidin-1-ylprop-2-en-1-one is 329059-03-2.
What is the molecular formula of 3-[4-(2-Methylpropyl)phenyl]-1-pyrrolidin-1-ylprop-2-en-1-one?
The molecular formula of 3-[4-(2-Methylpropyl)phenyl]-1-pyrrolidin-1-ylprop-2-en-1-one is C17H23NO.
What is the molecular weight of 3-[4-(2-Methylpropyl)phenyl]-1-pyrrolidin-1-ylprop-2-en-1-one?
The molecular weight of 3-[4-(2-Methylpropyl)phenyl]-1-pyrrolidin-1-ylprop-2-en-1-one is 257.18 g/mol.
Where can I buy 3-[4-(2-Methylpropyl)phenyl]-1-pyrrolidin-1-ylprop-2-en-1-one?
You can request a quote for 3-[4-(2-Methylpropyl)phenyl]-1-pyrrolidin-1-ylprop-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[4-(2-Methylpropyl)phenyl]-1-pyrrolidin-1-ylprop-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-(2-Methylpropyl)phenyl]-1-pyrrolidin-1-ylprop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.