N1-Benzyl-3-chloro-2,2-dimethylpropanamide
TL;DR: N1-Benzyl-3-chloro-2,2-dimethylpropanamide (CAS 82820-75-5) is a chemical compound with molecular formula C12H16ClNO and molecular weight 225.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-3-chloro-2,2-dimethylpropanamide
Also Known As: N1-Benzyl-3-chloro-2,2-dimethylpropanamide, N-benzyl-3-chloro-2,2-dimethylpropanamide, N-benzyl-3-chloro-2,2-dimethyl-propanamide, N-benzyl beta-chloro-alpha,alpha-dimethylpropionamide, 2-(Chloromethyl)-2-methyl-N-(phenylmethyl)propanamide
| Molecular Formula | C12H16ClNO |
|---|---|
| Molecular Weight | 225.09 g/mol |
| LogP | 2.5678 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 225.09204 |
| Heavy Atoms | 15 |
| Complexity | 321.6538 |
Chemical Identifiers
| CAS Number | 82820-75-5 |
|---|---|
| SMILES | CC(C)(CCl)C(=O)NCC1=CC=CC=C1 |
Product Overview
N1-Benzyl-3-chloro-2,2-dimethylpropanamide (CAS 82820-75-5), with molecular formula C12H16ClNO and molecular weight 225.09 g/mol. IUPAC: N-benzyl-3-chloro-2,2-dimethylpropanamide.
Chemical Property Profile of N1-Benzyl-3-chloro-2,2-dimethylpropanamide
Property Insights of N1-Benzyl-3-chloro-2,2-dimethylpropanamide
The XLogP value of 2.5678 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N1-Benzyl-3-chloro-2,2-dimethylpropanamide. With a topological polar surface area (TPSA) of 29.1 Ų, N1-Benzyl-3-chloro-2,2-dimethylpropanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N1-Benzyl-3-chloro-2,2-dimethylpropanamide has 1 hydrogen bond donor(s) and 1 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 N1-Benzyl-3-chloro-2,2-dimethylpropanamide?
The CAS number of N1-Benzyl-3-chloro-2,2-dimethylpropanamide is 82820-75-5.
What is the molecular formula of N1-Benzyl-3-chloro-2,2-dimethylpropanamide?
The molecular formula of N1-Benzyl-3-chloro-2,2-dimethylpropanamide is C12H16ClNO.
What is the molecular weight of N1-Benzyl-3-chloro-2,2-dimethylpropanamide?
The molecular weight of N1-Benzyl-3-chloro-2,2-dimethylpropanamide is 225.09 g/mol.
Where can I buy N1-Benzyl-3-chloro-2,2-dimethylpropanamide?
You can request a quote for N1-Benzyl-3-chloro-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 N1-Benzyl-3-chloro-2,2-dimethylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for N1-Benzyl-3-chloro-2,2-dimethylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.