N-methyl-N-(1-methyl-4-pyrrolidino-2-butynyl)acetamide
TL;DR: N-methyl-N-(1-methyl-4-pyrrolidino-2-butynyl)acetamide (CAS 83481-69-0) is a chemical compound with molecular formula C12H20N2O and molecular weight 208.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-N-(5-pyrrolidin-1-ylpent-3-yn-2-yl)acetamide
Also Known As: BM 5, N-methyl-N- acetamide, alpha-Methyl oxotremorine 1, N-methyl-N-(1-methyl-4-pyrrolidino-2-butynyl)acetamide, SID:134224574
| Molecular Formula | C12H20N2O |
|---|---|
| Molecular Weight | 208.16 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.15756 |
| Heavy Atoms | 15 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 83481-69-0 |
|---|---|
| SMILES | CC(C#CCN1CCCC1)N(C)C(=O)C |
| InChIKey | VHYUYQHTMPWAPK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-methyl-N-(1-methyl-4-pyrrolidino-2-butynyl)acetamide (CAS 83481-69-0), with molecular formula C12H20N2O and molecular weight 208.16 g/mol. IUPAC: N-methyl-N-(5-pyrrolidin-1-ylpent-3-yn-2-yl)acetamide.
Chemical Property Profile of N-methyl-N-(1-methyl-4-pyrrolidino-2-butynyl)acetamide
Property Insights of N-methyl-N-(1-methyl-4-pyrrolidino-2-butynyl)acetamide
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-methyl-N-(1-methyl-4-pyrrolidino-2-butynyl)acetamide. With a topological polar surface area (TPSA) of 23.6 Ų, N-methyl-N-(1-methyl-4-pyrrolidino-2-butynyl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-methyl-N-(1-methyl-4-pyrrolidino-2-butynyl)acetamide 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 N-methyl-N-(1-methyl-4-pyrrolidino-2-butynyl)acetamide?
The CAS number of N-methyl-N-(1-methyl-4-pyrrolidino-2-butynyl)acetamide is 83481-69-0.
What is the molecular formula of N-methyl-N-(1-methyl-4-pyrrolidino-2-butynyl)acetamide?
The molecular formula of N-methyl-N-(1-methyl-4-pyrrolidino-2-butynyl)acetamide is C12H20N2O.
What is the molecular weight of N-methyl-N-(1-methyl-4-pyrrolidino-2-butynyl)acetamide?
The molecular weight of N-methyl-N-(1-methyl-4-pyrrolidino-2-butynyl)acetamide is 208.16 g/mol.
Where can I buy N-methyl-N-(1-methyl-4-pyrrolidino-2-butynyl)acetamide?
You can request a quote for N-methyl-N-(1-methyl-4-pyrrolidino-2-butynyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-methyl-N-(1-methyl-4-pyrrolidino-2-butynyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-methyl-N-(1-methyl-4-pyrrolidino-2-butynyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.