Carbamic acid, N-ethyl-, 2-((2-cyanoethyl)phenylamino)ethyl ester
TL;DR: Carbamic acid, N-ethyl-, 2-((2-cyanoethyl)phenylamino)ethyl ester (CAS 63216-95-5) is a chemical compound with molecular formula C14H19N3O2 and molecular weight 261.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[N-(2-cyanoethyl)anilino]ethyl N-ethylcarbamate
Also Known As: 2-[(2-CYANOETHYL)PHENYLAMINO]ETHYL ETHYLCARBAMATE, 2-[(2-cyanoethyl)(phenyl)amino]ethyl ethylcarbamate, 2-((2-Cyanoethyl)phenylamino)ethyl ethylcarbamate, 2-[N-(2-cyanoethyl)anilino]ethyl N-ethylcarbamate, Carbamic acid, ethyl-, 2-((2-cyanoethyl)phenylamino)ethyl ester
| Molecular Formula | C14H19N3O2 |
|---|---|
| Molecular Weight | 261.15 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 65.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 261.14774 |
| Heavy Atoms | 19 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 63216-95-5 |
|---|---|
| SMILES | CCNC(=O)OCCN(CCC#N)C1=CC=CC=C1 |
| InChIKey | RQMOPOXAUBOEEP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Carbamic acid, N-ethyl-, 2-((2-cyanoethyl)phenylamino)ethyl ester (CAS 63216-95-5), with molecular formula C14H19N3O2 and molecular weight 261.15 g/mol. IUPAC: 2-[N-(2-cyanoethyl)anilino]ethyl N-ethylcarbamate.
Chemical Property Profile of Carbamic acid, N-ethyl-, 2-((2-cyanoethyl)phenylamino)ethyl ester
Property Insights of Carbamic acid, N-ethyl-, 2-((2-cyanoethyl)phenylamino)ethyl ester
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, N-ethyl-, 2-((2-cyanoethyl)phenylamino)ethyl ester. The TPSA of 65.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid, N-ethyl-, 2-((2-cyanoethyl)phenylamino)ethyl ester. Following Lipinski's Rule of Five, Carbamic acid, N-ethyl-, 2-((2-cyanoethyl)phenylamino)ethyl ester has 1 hydrogen bond donor(s) and 4 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 Carbamic acid, N-ethyl-, 2-((2-cyanoethyl)phenylamino)ethyl ester?
The CAS number of Carbamic acid, N-ethyl-, 2-((2-cyanoethyl)phenylamino)ethyl ester is 63216-95-5.
What is the molecular formula of Carbamic acid, N-ethyl-, 2-((2-cyanoethyl)phenylamino)ethyl ester?
The molecular formula of Carbamic acid, N-ethyl-, 2-((2-cyanoethyl)phenylamino)ethyl ester is C14H19N3O2.
What is the molecular weight of Carbamic acid, N-ethyl-, 2-((2-cyanoethyl)phenylamino)ethyl ester?
The molecular weight of Carbamic acid, N-ethyl-, 2-((2-cyanoethyl)phenylamino)ethyl ester is 261.15 g/mol.
Where can I buy Carbamic acid, N-ethyl-, 2-((2-cyanoethyl)phenylamino)ethyl ester?
You can request a quote for Carbamic acid, N-ethyl-, 2-((2-cyanoethyl)phenylamino)ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, N-ethyl-, 2-((2-cyanoethyl)phenylamino)ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, N-ethyl-, 2-((2-cyanoethyl)phenylamino)ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.