2-Butenamide, 3-amino-N-phenyl-, (Z)-
TL;DR: 2-Butenamide, 3-amino-N-phenyl-, (Z)- (CAS 59846-47-8) is a chemical compound with molecular formula C10H12N2O and molecular weight 176.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-N-phenylbut-2-enamide
Also Known As: 3-amino-N-phenylbut-2-enamide, (Z)-3-amino-N-phenylbut-2-enamide, 2-Butenamide, 3-amino-N-phenyl-, (Z)-
| Molecular Formula | C10H12N2O |
|---|---|
| Molecular Weight | 176.09 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 176.09496 |
| Heavy Atoms | 13 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 59846-47-8 |
|---|---|
| SMILES | CC(=CC(=O)NC1=CC=CC=C1)N |
| InChIKey | YWTRXACYCWOQMR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Butenamide, 3-amino-N-phenyl-, (Z)- (CAS 59846-47-8), with molecular formula C10H12N2O and molecular weight 176.09 g/mol. IUPAC: 3-amino-N-phenylbut-2-enamide.
Chemical Property Profile of 2-Butenamide, 3-amino-N-phenyl-, (Z)-
Property Insights of 2-Butenamide, 3-amino-N-phenyl-, (Z)-
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Butenamide, 3-amino-N-phenyl-, (Z)-. With a topological polar surface area (TPSA) of 55.1 Ų, 2-Butenamide, 3-amino-N-phenyl-, (Z)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butenamide, 3-amino-N-phenyl-, (Z)- has 2 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-Butenamide, 3-amino-N-phenyl-, (Z)-?
The CAS number of 2-Butenamide, 3-amino-N-phenyl-, (Z)- is 59846-47-8.
What is the molecular formula of 2-Butenamide, 3-amino-N-phenyl-, (Z)-?
The molecular formula of 2-Butenamide, 3-amino-N-phenyl-, (Z)- is C10H12N2O.
What is the molecular weight of 2-Butenamide, 3-amino-N-phenyl-, (Z)-?
The molecular weight of 2-Butenamide, 3-amino-N-phenyl-, (Z)- is 176.09 g/mol.
Where can I buy 2-Butenamide, 3-amino-N-phenyl-, (Z)-?
You can request a quote for 2-Butenamide, 3-amino-N-phenyl-, (Z)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butenamide, 3-amino-N-phenyl-, (Z)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Butenamide, 3-amino-N-phenyl-, (Z)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.