N-isoquinolin-1-yl-2,2-dimethylpropanamide
TL;DR: N-isoquinolin-1-yl-2,2-dimethylpropanamide (CAS 40339-93-3) is a chemical compound with molecular formula C14H16N2O and molecular weight 228.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-isoquinolin-1-yl-2,2-dimethylpropanamide
Also Known As: N-isoquinolin-1-yl-2,2-dimethylpropanamide, N-(isoquinolin-1-yl)-2,2-dimethylpropanamide, Propanamide, N-1-isoquinolinyl-2,2-dimethyl-, N-(1-Isoquinolyl)-2,2-dimethylpropanamide, N-(1-Isoquinolinyl)-2,2-dimethylpropanamide
| Molecular Formula | C14H16N2O |
|---|---|
| Molecular Weight | 228.13 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 42.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.12627 |
| Heavy Atoms | 17 |
| Complexity | 282.0 |
Chemical Identifiers
| CAS Number | 40339-93-3 |
|---|---|
| SMILES | CC(C)(C)C(=O)NC1=NC=CC2=CC=CC=C21 |
| InChIKey | GBNOTAQDJOWGEX-UHFFFAOYSA-N |
Product Overview
N-isoquinolin-1-yl-2,2-dimethylpropanamide (CAS 40339-93-3), with molecular formula C14H16N2O and molecular weight 228.13 g/mol. IUPAC: N-isoquinolin-1-yl-2,2-dimethylpropanamide.
Chemical Property Profile of N-isoquinolin-1-yl-2,2-dimethylpropanamide
Property Insights of N-isoquinolin-1-yl-2,2-dimethylpropanamide
The XLogP value of 3.0 indicates that N-isoquinolin-1-yl-2,2-dimethylpropanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.0 Ų, N-isoquinolin-1-yl-2,2-dimethylpropanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-isoquinolin-1-yl-2,2-dimethylpropanamide 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 N-isoquinolin-1-yl-2,2-dimethylpropanamide?
The CAS number of N-isoquinolin-1-yl-2,2-dimethylpropanamide is 40339-93-3.
What is the molecular formula of N-isoquinolin-1-yl-2,2-dimethylpropanamide?
The molecular formula of N-isoquinolin-1-yl-2,2-dimethylpropanamide is C14H16N2O.
What is the molecular weight of N-isoquinolin-1-yl-2,2-dimethylpropanamide?
The molecular weight of N-isoquinolin-1-yl-2,2-dimethylpropanamide is 228.13 g/mol.
Where can I buy N-isoquinolin-1-yl-2,2-dimethylpropanamide?
You can request a quote for N-isoquinolin-1-yl-2,2-dimethylpropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-isoquinolin-1-yl-2,2-dimethylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for N-isoquinolin-1-yl-2,2-dimethylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.