1-(3,6-Dimethylpentadecanoyl)pyrrolidine
TL;DR: 1-(3,6-Dimethylpentadecanoyl)pyrrolidine (CAS 56630-62-7) is a chemical compound with molecular formula C21H41NO and molecular weight 323.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,6-dimethyl-1-pyrrolidin-1-ylpentadecan-1-one
Also Known As: 1-(3,6-Dimethylpentadecanoyl)pyrrolidine, 1-(3,6-Dimethylpentadecanoyl)pyrrolidine #, Pyrrolidine, 1-(3,6-dimethyl-1-oxopentadecyl)-, 3,6-dimethyl-1-(pyrrolidin-1-yl)pentadecan-1-one, 3,6-dimethyl-1-pyrrolidin-1-ylpentadecan-1-one
| Molecular Formula | C21H41NO |
|---|---|
| Molecular Weight | 323.32 g/mol |
| LogP | 7.7 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 13 |
| Exact Mass | 323.31882 |
| Heavy Atoms | 23 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 56630-62-7 |
|---|---|
| SMILES | CCCCCCCCCC(C)CCC(C)CC(=O)N1CCCC1 |
| InChIKey | HXWPQXBCSCJOHL-UHFFFAOYSA-N |
Product Overview
1-(3,6-Dimethylpentadecanoyl)pyrrolidine (CAS 56630-62-7), with molecular formula C21H41NO and molecular weight 323.32 g/mol. IUPAC: 3,6-dimethyl-1-pyrrolidin-1-ylpentadecan-1-one.
Chemical Property Profile of 1-(3,6-Dimethylpentadecanoyl)pyrrolidine
Property Insights of 1-(3,6-Dimethylpentadecanoyl)pyrrolidine
The XLogP value of 7.7 indicates that 1-(3,6-Dimethylpentadecanoyl)pyrrolidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 1-(3,6-Dimethylpentadecanoyl)pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,6-Dimethylpentadecanoyl)pyrrolidine has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(3,6-Dimethylpentadecanoyl)pyrrolidine?
The CAS number of 1-(3,6-Dimethylpentadecanoyl)pyrrolidine is 56630-62-7.
What is the molecular formula of 1-(3,6-Dimethylpentadecanoyl)pyrrolidine?
The molecular formula of 1-(3,6-Dimethylpentadecanoyl)pyrrolidine is C21H41NO.
What is the molecular weight of 1-(3,6-Dimethylpentadecanoyl)pyrrolidine?
The molecular weight of 1-(3,6-Dimethylpentadecanoyl)pyrrolidine is 323.32 g/mol.
Where can I buy 1-(3,6-Dimethylpentadecanoyl)pyrrolidine?
You can request a quote for 1-(3,6-Dimethylpentadecanoyl)pyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,6-Dimethylpentadecanoyl)pyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,6-Dimethylpentadecanoyl)pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.