N,N-bis(2-cyanoethyl)acetamide
TL;DR: N,N-bis(2-cyanoethyl)acetamide (CAS 42149-77-9) is a chemical compound with molecular formula C8H11N3O and molecular weight 165.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-bis(2-cyanoethyl)acetamide
Also Known As: N,N-bis(2-cyanoethyl)acetamide, Acetyl-bis-<2-cyan-ethyl>-amin, AZ0001-0439
| Molecular Formula | C8H11N3O |
|---|---|
| Molecular Weight | 165.09 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 67.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 165.09021 |
| Heavy Atoms | 12 |
| Complexity | 222.0 |
Chemical Identifiers
| CAS Number | 42149-77-9 |
|---|---|
| SMILES | CC(=O)N(CCC#N)CCC#N |
| InChIKey | YSPPZFZYYWAMRV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N-bis(2-cyanoethyl)acetamide (CAS 42149-77-9), with molecular formula C8H11N3O and molecular weight 165.09 g/mol. IUPAC: N,N-bis(2-cyanoethyl)acetamide.
Chemical Property Profile of N,N-bis(2-cyanoethyl)acetamide
Property Insights of N,N-bis(2-cyanoethyl)acetamide
The XLogP value of -0.9 indicates that N,N-bis(2-cyanoethyl)acetamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 67.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-bis(2-cyanoethyl)acetamide. Following Lipinski's Rule of Five, N,N-bis(2-cyanoethyl)acetamide has 0 hydrogen bond donor(s) and 3 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,N-bis(2-cyanoethyl)acetamide?
The CAS number of N,N-bis(2-cyanoethyl)acetamide is 42149-77-9.
What is the molecular formula of N,N-bis(2-cyanoethyl)acetamide?
The molecular formula of N,N-bis(2-cyanoethyl)acetamide is C8H11N3O.
What is the molecular weight of N,N-bis(2-cyanoethyl)acetamide?
The molecular weight of N,N-bis(2-cyanoethyl)acetamide is 165.09 g/mol.
Where can I buy N,N-bis(2-cyanoethyl)acetamide?
You can request a quote for N,N-bis(2-cyanoethyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-bis(2-cyanoethyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N,N-bis(2-cyanoethyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.