9-Acetamido-1-methyl-3,6-diazahomoadamantane
TL;DR: 9-Acetamido-1-methyl-3,6-diazahomoadamantane (CAS 1212439-58-1) is a chemical compound with molecular formula C12H21N3O and molecular weight 223.16846 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(1-methyl-3,6-diazatricyclo[4.3.1.13,8]undecan-9-yl)acetamide
Also Known As: 9-Acetamido-1-methyl-3,6-diazahomoadamantane, N-(1-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undec-9-yl)acetamide, N-(1-methyl-3,6-diazatricyclo[4.3.1.1<3,8>]undec-9-yl)acetamide, N-((1S,3S,8R)-1-methyl-3,6-diazatricyclo[4.3.1.1(3,8)]undecan-9-yl)acetamide
Technical Specifications
| Molecular Formula | C12H21N3O |
| Molecular Weight | 223.16846 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 35.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 223.16846 Da |
| Heavy Atoms | 16 |
| Complexity | 301.0 |
| SMILES | CC(=O)NC1C2CN3CCN(C2)CC1(C3)C |
| InChIKey | JPPPYUYKCCUCJW-UHFFFAOYSA-N |
Chemical Property Profile of 9-Acetamido-1-methyl-3,6-diazahomoadamantane
Property Insights of 9-Acetamido-1-methyl-3,6-diazahomoadamantane
The XLogP value of -0.1 indicates that 9-Acetamido-1-methyl-3,6-diazahomoadamantane is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 35.6 Ų, 9-Acetamido-1-methyl-3,6-diazahomoadamantane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Acetamido-1-methyl-3,6-diazahomoadamantane has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 9-Acetamido-1-methyl-3,6-diazahomoadamantane?
The CAS number of 9-Acetamido-1-methyl-3,6-diazahomoadamantane is 1212439-58-1.
What is the molecular formula of 9-Acetamido-1-methyl-3,6-diazahomoadamantane?
The molecular formula of 9-Acetamido-1-methyl-3,6-diazahomoadamantane is C12H21N3O.
What is the molecular weight of 9-Acetamido-1-methyl-3,6-diazahomoadamantane?
The molecular weight of 9-Acetamido-1-methyl-3,6-diazahomoadamantane is 223.16846 g/mol.
Where can I buy 9-Acetamido-1-methyl-3,6-diazahomoadamantane?
You can request a quote for 9-Acetamido-1-methyl-3,6-diazahomoadamantane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 9-Acetamido-1-methyl-3,6-diazahomoadamantane?
Yes, CoreyChem provides custom synthesis services for 9-Acetamido-1-methyl-3,6-diazahomoadamantane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.