3,5-Dimethylpiperidyl 4-methylphenyl ketone
TL;DR: 3,5-Dimethylpiperidyl 4-methylphenyl ketone (CAS 331845-85-3) is a chemical compound with molecular formula C15H21NO and molecular weight 231.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,5-dimethylpiperidin-1-yl)-(4-methylphenyl)methanone
Also Known As: TimTec1_003018, BAS 00623361, 3,5-dimethylpiperidyl 4-methylphenyl ketone, 3,5-DIMETHYL-1-(4-METHYLBENZOYL)PIPERIDINE, AB01325564-02
| Molecular Formula | C15H21NO |
|---|---|
| Molecular Weight | 231.16 g/mol |
| LogP | 3.11312 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 231.16231 |
| Heavy Atoms | 17 |
| Complexity | 385.8878 |
Chemical Identifiers
| CAS Number | 331845-85-3 |
|---|---|
| SMILES | CC1CC(CN(C1)C(=O)C2=CC=C(C=C2)C)C |
Product Overview
3,5-Dimethylpiperidyl 4-methylphenyl ketone (CAS 331845-85-3), with molecular formula C15H21NO and molecular weight 231.16 g/mol. IUPAC: (3,5-dimethylpiperidin-1-yl)-(4-methylphenyl)methanone.
Chemical Property Profile of 3,5-Dimethylpiperidyl 4-methylphenyl ketone
Property Insights of 3,5-Dimethylpiperidyl 4-methylphenyl ketone
The XLogP value of 3.11312 indicates that 3,5-Dimethylpiperidyl 4-methylphenyl ketone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, 3,5-Dimethylpiperidyl 4-methylphenyl ketone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Dimethylpiperidyl 4-methylphenyl ketone 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 3,5-Dimethylpiperidyl 4-methylphenyl ketone?
The CAS number of 3,5-Dimethylpiperidyl 4-methylphenyl ketone is 331845-85-3.
What is the molecular formula of 3,5-Dimethylpiperidyl 4-methylphenyl ketone?
The molecular formula of 3,5-Dimethylpiperidyl 4-methylphenyl ketone is C15H21NO.
What is the molecular weight of 3,5-Dimethylpiperidyl 4-methylphenyl ketone?
The molecular weight of 3,5-Dimethylpiperidyl 4-methylphenyl ketone is 231.16 g/mol.
Where can I buy 3,5-Dimethylpiperidyl 4-methylphenyl ketone?
You can request a quote for 3,5-Dimethylpiperidyl 4-methylphenyl ketone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dimethylpiperidyl 4-methylphenyl ketone?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dimethylpiperidyl 4-methylphenyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.