2-cyano-N-(3-phenylpropyl)acetamide
TL;DR: 2-cyano-N-(3-phenylpropyl)acetamide (CAS 133550-33-1) is a chemical compound with molecular formula C12H14N2O and molecular weight 202.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyano-N-(3-phenylpropyl)acetamide
Also Known As: 2-cyano-N-(3-phenylpropyl)acetamide, Acetamide, 2-cyano-N-(3-phenylpropyl)-, N-3-phenyl-n-propyl cyanoacetamide, n-(3-phenyl-n-propyl)cyanoacetamide, N-(3-phenylpropyl)-2-cyanoethanamide
| Molecular Formula | C12H14N2O |
|---|---|
| Molecular Weight | 202.11 g/mol |
| LogP | 1.64908 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 202.11061 |
| Heavy Atoms | 15 |
| Complexity | 340.3898 |
Chemical Identifiers
| CAS Number | 133550-33-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCCNC(=O)CC#N |
Product Overview
2-cyano-N-(3-phenylpropyl)acetamide (CAS 133550-33-1), with molecular formula C12H14N2O and molecular weight 202.11 g/mol. IUPAC: 2-cyano-N-(3-phenylpropyl)acetamide.
Chemical Property Profile of 2-cyano-N-(3-phenylpropyl)acetamide
Property Insights of 2-cyano-N-(3-phenylpropyl)acetamide
The XLogP value of 1.64908 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-cyano-N-(3-phenylpropyl)acetamide. With a topological polar surface area (TPSA) of 52.89 Ų, 2-cyano-N-(3-phenylpropyl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-cyano-N-(3-phenylpropyl)acetamide 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 2-cyano-N-(3-phenylpropyl)acetamide?
The CAS number of 2-cyano-N-(3-phenylpropyl)acetamide is 133550-33-1.
What is the molecular formula of 2-cyano-N-(3-phenylpropyl)acetamide?
The molecular formula of 2-cyano-N-(3-phenylpropyl)acetamide is C12H14N2O.
What is the molecular weight of 2-cyano-N-(3-phenylpropyl)acetamide?
The molecular weight of 2-cyano-N-(3-phenylpropyl)acetamide is 202.11 g/mol.
Where can I buy 2-cyano-N-(3-phenylpropyl)acetamide?
You can request a quote for 2-cyano-N-(3-phenylpropyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-cyano-N-(3-phenylpropyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-cyano-N-(3-phenylpropyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.