Methyl 2-(adamantan-1-YL)-2-aminoacetate
TL;DR: Methyl 2-(adamantan-1-YL)-2-aminoacetate (CAS 95853-31-9) is a chemical compound with molecular formula C13H21NO2 and molecular weight 223.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(1-adamantyl)-2-aminoacetate
Also Known As: METHYL 2-(ADAMANTAN-1-YL)-2-AMINOACETATE, Methyl 2-(1-adamantyl)-2-amino-acetate, METHYL 1-ADAMANTYL(AMINO)ACETATE, methyl 2-(1-adamantyl)-2-aminoacetate, J1.256.809F
| Molecular Formula | C13H21NO2 |
|---|---|
| Molecular Weight | 223.16 g/mol |
| LogP | 1.7031 |
| Topological Polar Surface Area | 52.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 223.15723 |
| Heavy Atoms | 16 |
| Complexity | 277.77023 |
Chemical Identifiers
| CAS Number | 95853-31-9 |
|---|---|
| SMILES | COC(=O)C(C12CC3CC(C1)CC(C3)C2)N |
Product Overview
Methyl 2-(adamantan-1-YL)-2-aminoacetate (CAS 95853-31-9), with molecular formula C13H21NO2 and molecular weight 223.16 g/mol. IUPAC: methyl 2-(1-adamantyl)-2-aminoacetate.
Chemical Property Profile of Methyl 2-(adamantan-1-YL)-2-aminoacetate
Property Insights of Methyl 2-(adamantan-1-YL)-2-aminoacetate
The XLogP value of 1.7031 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-(adamantan-1-YL)-2-aminoacetate. With a topological polar surface area (TPSA) of 52.32 Ų, Methyl 2-(adamantan-1-YL)-2-aminoacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-(adamantan-1-YL)-2-aminoacetate 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
Frequently Asked Questions
What is the CAS number of Methyl 2-(adamantan-1-YL)-2-aminoacetate?
The CAS number of Methyl 2-(adamantan-1-YL)-2-aminoacetate is 95853-31-9.
What is the molecular formula of Methyl 2-(adamantan-1-YL)-2-aminoacetate?
The molecular formula of Methyl 2-(adamantan-1-YL)-2-aminoacetate is C13H21NO2.
What is the molecular weight of Methyl 2-(adamantan-1-YL)-2-aminoacetate?
The molecular weight of Methyl 2-(adamantan-1-YL)-2-aminoacetate is 223.16 g/mol.
Where can I buy Methyl 2-(adamantan-1-YL)-2-aminoacetate?
You can request a quote for Methyl 2-(adamantan-1-YL)-2-aminoacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(adamantan-1-YL)-2-aminoacetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(adamantan-1-YL)-2-aminoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.