N-(4-methoxyphenyl)-1,2-diazabicyclo[2.2.2]octane-2-carboxamide
TL;DR: N-(4-methoxyphenyl)-1,2-diazabicyclo[2.2.2]octane-2-carboxamide (CAS 83407-81-2) is a chemical compound with molecular formula C14H19N3O2 and molecular weight 261.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methoxyphenyl)-1,2-diazabicyclo[2.2.2]octane-2-carboxamide
Also Known As: N-(4-methoxyphenyl)-1,2-diazabicyclo[2.2.2]octane-2-carboxamide, N-(4-methoxyphenyl)-1,2-diazabicyclo[2.2.2]octane-2-carboxam, N-(4-methoxyphenyl)-1,7-diazabicyclo[2.2.2]octane-7-carboxamide
| Molecular Formula | C14H19N3O2 |
|---|---|
| Molecular Weight | 261.15 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 261.14774 |
| Heavy Atoms | 19 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 83407-81-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)N2CC3CCN2CC3 |
| InChIKey | NENCIZMGBGGAAR-UHFFFAOYSA-N |
Product Overview
N-(4-methoxyphenyl)-1,2-diazabicyclo[2.2.2]octane-2-carboxamide (CAS 83407-81-2), with molecular formula C14H19N3O2 and molecular weight 261.15 g/mol. IUPAC: N-(4-methoxyphenyl)-1,2-diazabicyclo[2.2.2]octane-2-carboxamide.
Chemical Property Profile of N-(4-methoxyphenyl)-1,2-diazabicyclo[2.2.2]octane-2-carboxamide
Property Insights of N-(4-methoxyphenyl)-1,2-diazabicyclo[2.2.2]octane-2-carboxamide
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-methoxyphenyl)-1,2-diazabicyclo[2.2.2]octane-2-carboxamide. With a topological polar surface area (TPSA) of 44.8 Ų, N-(4-methoxyphenyl)-1,2-diazabicyclo[2.2.2]octane-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-methoxyphenyl)-1,2-diazabicyclo[2.2.2]octane-2-carboxamide 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-(4-methoxyphenyl)-1,2-diazabicyclo[2.2.2]octane-2-carboxamide?
The CAS number of N-(4-methoxyphenyl)-1,2-diazabicyclo[2.2.2]octane-2-carboxamide is 83407-81-2.
What is the molecular formula of N-(4-methoxyphenyl)-1,2-diazabicyclo[2.2.2]octane-2-carboxamide?
The molecular formula of N-(4-methoxyphenyl)-1,2-diazabicyclo[2.2.2]octane-2-carboxamide is C14H19N3O2.
What is the molecular weight of N-(4-methoxyphenyl)-1,2-diazabicyclo[2.2.2]octane-2-carboxamide?
The molecular weight of N-(4-methoxyphenyl)-1,2-diazabicyclo[2.2.2]octane-2-carboxamide is 261.15 g/mol.
Where can I buy N-(4-methoxyphenyl)-1,2-diazabicyclo[2.2.2]octane-2-carboxamide?
You can request a quote for N-(4-methoxyphenyl)-1,2-diazabicyclo[2.2.2]octane-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-methoxyphenyl)-1,2-diazabicyclo[2.2.2]octane-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-methoxyphenyl)-1,2-diazabicyclo[2.2.2]octane-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.