Oxotremorine 1
TL;DR: Oxotremorine 1 (CAS 3854-05-5) is a chemical compound with molecular formula C11H18N2O and molecular weight 194.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-N-(4-pyrrolidin-1-ylbut-2-ynyl)acetamide
Also Known As: Oxotremorine 1, Oxo 1, N-Methyl-N-(4-pyrrolidin-1'-ylbut-2-ynyl)acetamide, ACETAMIDE, N-METHYL-N-(4-(1-PYRROLIDINYL)-2-BUTYNYL)-, N-methyl-N-(4-pyrrolidino-2-butynyl)acetamide
| Molecular Formula | C11H18N2O |
|---|---|
| Molecular Weight | 194.14 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 194.1419 |
| Heavy Atoms | 14 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 3854-05-5 |
|---|---|
| SMILES | CC(=O)N(C)CC#CCN1CCCC1 |
| InChIKey | HWYHDWGGACRVEH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Oxotremorine 1 (CAS 3854-05-5), with molecular formula C11H18N2O and molecular weight 194.14 g/mol. IUPAC: N-methyl-N-(4-pyrrolidin-1-ylbut-2-ynyl)acetamide.
Chemical Property Profile of Oxotremorine 1
Property Insights of Oxotremorine 1
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oxotremorine 1. With a topological polar surface area (TPSA) of 23.6 Ų, Oxotremorine 1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxotremorine 1 has 0 hydrogen bond donor(s) and 2 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 Oxotremorine 1?
The CAS number of Oxotremorine 1 is 3854-05-5.
What is the molecular formula of Oxotremorine 1?
The molecular formula of Oxotremorine 1 is C11H18N2O.
What is the molecular weight of Oxotremorine 1?
The molecular weight of Oxotremorine 1 is 194.14 g/mol.
Where can I buy Oxotremorine 1?
You can request a quote for Oxotremorine 1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxotremorine 1?
Yes, KEHONG BIO provides custom synthesis services for Oxotremorine 1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.