3-Acetylaminoquinoline
TL;DR: 3-Acetylaminoquinoline (CAS 5417-50-5) is a chemical compound with molecular formula C11H10N2O and molecular weight 186.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-quinolin-3-ylacetamide
Also Known As: 3-Acetylaminoquinoline, n-(quinolin-3-yl)acetamide, Acetamide, N-3-quinolinyl-, 3-acetamidoquinoline, 3-(acetylamino)quinoline
| Molecular Formula | C11H10N2O |
|---|---|
| Molecular Weight | 186.08 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 42.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 186.07932 |
| Heavy Atoms | 14 |
| Complexity | 217.0 |
Chemical Identifiers
| CAS Number | 5417-50-5 |
|---|---|
| SMILES | CC(=O)NC1=CC2=CC=CC=C2N=C1 |
| InChIKey | VAECZJVLTOQMGP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Acetylaminoquinoline (CAS 5417-50-5), with molecular formula C11H10N2O and molecular weight 186.08 g/mol. IUPAC: N-quinolin-3-ylacetamide.
Chemical Property Profile of 3-Acetylaminoquinoline
Property Insights of 3-Acetylaminoquinoline
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Acetylaminoquinoline. With a topological polar surface area (TPSA) of 42.0 Ų, 3-Acetylaminoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Acetylaminoquinoline has 1 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 3-Acetylaminoquinoline?
The CAS number of 3-Acetylaminoquinoline is 5417-50-5.
What is the molecular formula of 3-Acetylaminoquinoline?
The molecular formula of 3-Acetylaminoquinoline is C11H10N2O.
What is the molecular weight of 3-Acetylaminoquinoline?
The molecular weight of 3-Acetylaminoquinoline is 186.08 g/mol.
Where can I buy 3-Acetylaminoquinoline?
You can request a quote for 3-Acetylaminoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Acetylaminoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 3-Acetylaminoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.