N-(3,4-Dimethoxybenzyl)-1-adamantanecarboxamide
TL;DR: N-(3,4-Dimethoxybenzyl)-1-adamantanecarboxamide (CAS 42600-92-0) is a chemical compound with molecular formula C20H27NO3 and molecular weight 329.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3,4-dimethoxyphenyl)methyl]adamantane-1-carboxamide
Also Known As: N-(3,4-Dimethoxybenzyl)-1-adamantanecarboxamide, adamantanyl-N-[(3,4-dimethoxyphenyl)methyl]carboxamide, N-[(3,4-dimethoxyphenyl)methyl]adamantane-1-carboxamide, (3r,5r,7r)-N-(3,4-dimethoxybenzyl)adamantane-1-carboxamide, N-(3,4-dimethoxybenzyl)tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
| Molecular Formula | C20H27NO3 |
|---|---|
| Molecular Weight | 329.20 g/mol |
| LogP | 3.5364 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 329.1991 |
| Heavy Atoms | 24 |
| Complexity | 604.48694 |
Chemical Identifiers
| CAS Number | 42600-92-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CNC(=O)C23CC4CC(C2)CC(C4)C3)OC |
Product Overview
N-(3,4-Dimethoxybenzyl)-1-adamantanecarboxamide (CAS 42600-92-0), with molecular formula C20H27NO3 and molecular weight 329.20 g/mol. IUPAC: N-[(3,4-dimethoxyphenyl)methyl]adamantane-1-carboxamide.
Chemical Property Profile of N-(3,4-Dimethoxybenzyl)-1-adamantanecarboxamide
Property Insights of N-(3,4-Dimethoxybenzyl)-1-adamantanecarboxamide
The XLogP value of 3.5364 indicates that N-(3,4-Dimethoxybenzyl)-1-adamantanecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.56 Ų, N-(3,4-Dimethoxybenzyl)-1-adamantanecarboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3,4-Dimethoxybenzyl)-1-adamantanecarboxamide 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 N-(3,4-Dimethoxybenzyl)-1-adamantanecarboxamide?
The CAS number of N-(3,4-Dimethoxybenzyl)-1-adamantanecarboxamide is 42600-92-0.
What is the molecular formula of N-(3,4-Dimethoxybenzyl)-1-adamantanecarboxamide?
The molecular formula of N-(3,4-Dimethoxybenzyl)-1-adamantanecarboxamide is C20H27NO3.
What is the molecular weight of N-(3,4-Dimethoxybenzyl)-1-adamantanecarboxamide?
The molecular weight of N-(3,4-Dimethoxybenzyl)-1-adamantanecarboxamide is 329.20 g/mol.
Where can I buy N-(3,4-Dimethoxybenzyl)-1-adamantanecarboxamide?
You can request a quote for N-(3,4-Dimethoxybenzyl)-1-adamantanecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,4-Dimethoxybenzyl)-1-adamantanecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3,4-Dimethoxybenzyl)-1-adamantanecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.