Phenethanamine, N-acetyl-4-cyano-
TL;DR: Phenethanamine, N-acetyl-4-cyano- (CAS 959092-15-0) is a chemical compound with molecular formula C11H12N2O and molecular weight 188.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-cyanophenyl)ethyl]acetamide
Also Known As: N-(4-cyanophenethyl)acetamide, Phenethanamine, N-acetyl-4-cyano-, N-[2-(4-Cyanophenyl)ethyl]acetamide, N-[2-(4-Cyanophenyl)ethyl]acetamide #, Acetamide, N-[2-(4-cyanophenyl)ethyl]-
| Molecular Formula | C11H12N2O |
|---|---|
| Molecular Weight | 188.09 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 188.09496 |
| Heavy Atoms | 14 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 959092-15-0 |
|---|---|
| SMILES | CC(=O)NCCC1=CC=C(C=C1)C#N |
| InChIKey | QTWCQQWGWKIVCM-UHFFFAOYSA-N |
Product Overview
Phenethanamine, N-acetyl-4-cyano- (CAS 959092-15-0), with molecular formula C11H12N2O and molecular weight 188.09 g/mol. IUPAC: N-[2-(4-cyanophenyl)ethyl]acetamide.
Chemical Property Profile of Phenethanamine, N-acetyl-4-cyano-
Property Insights of Phenethanamine, N-acetyl-4-cyano-
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenethanamine, N-acetyl-4-cyano-. With a topological polar surface area (TPSA) of 52.9 Ų, Phenethanamine, N-acetyl-4-cyano- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenethanamine, N-acetyl-4-cyano- 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 Phenethanamine, N-acetyl-4-cyano-?
The CAS number of Phenethanamine, N-acetyl-4-cyano- is 959092-15-0.
What is the molecular formula of Phenethanamine, N-acetyl-4-cyano-?
The molecular formula of Phenethanamine, N-acetyl-4-cyano- is C11H12N2O.
What is the molecular weight of Phenethanamine, N-acetyl-4-cyano-?
The molecular weight of Phenethanamine, N-acetyl-4-cyano- is 188.09 g/mol.
Where can I buy Phenethanamine, N-acetyl-4-cyano-?
You can request a quote for Phenethanamine, N-acetyl-4-cyano- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenethanamine, N-acetyl-4-cyano-?
Yes, KEHONG BIO provides custom synthesis services for Phenethanamine, N-acetyl-4-cyano- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.