α,β-二甲基-N-(2-丙炔基)肉桂酰胺
TL;DR: α,β-二甲基-N-(2-丙炔基)肉桂酰胺 (CAS 56604-92-3) is a chemical compound with molecular formula C14H15NO and molecular weight 213.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
α,β-二甲基-N-(2-丙炔基)肉桂酰胺
2-methyl-3-phenyl-N-prop-2-ynylbut-2-enamide
Also Known As: alpha,beta-Dimethyl-N-(2-propynyl)cinnamamide
| Molecular Formula | C14H15NO |
|---|---|
| Molecular Weight | 213.12 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 213.11537 |
| Heavy Atoms | 16 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 56604-92-3 |
|---|---|
| SMILES | CC(=C(C)C(=O)NCC#C)C1=CC=CC=C1 |
| InChIKey | LEHGCEPMNDWJMX-UHFFFAOYSA-N |
Product Overview
α,β-二甲基-N-(2-丙炔基)肉桂酰胺 (CAS 56604-92-3), with molecular formula C14H15NO and molecular weight 213.12 g/mol. IUPAC: 2-methyl-3-phenyl-N-prop-2-ynylbut-2-enamide.
Chemical Property Profile of α,β-二甲基-N-(2-丙炔基)肉桂酰胺
Property Insights of α,β-二甲基-N-(2-丙炔基)肉桂酰胺
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for α,β-二甲基-N-(2-丙炔基)肉桂酰胺. With a topological polar surface area (TPSA) of 29.1 Ų, α,β-二甲基-N-(2-丙炔基)肉桂酰胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, α,β-二甲基-N-(2-丙炔基)肉桂酰胺 has 1 hydrogen bond donor(s) and 1 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 α,β-二甲基-N-(2-丙炔基)肉桂酰胺?
The CAS number of α,β-二甲基-N-(2-丙炔基)肉桂酰胺 is 56604-92-3.
What is the molecular formula of α,β-二甲基-N-(2-丙炔基)肉桂酰胺?
The molecular formula of α,β-二甲基-N-(2-丙炔基)肉桂酰胺 is C14H15NO.
What is the molecular weight of α,β-二甲基-N-(2-丙炔基)肉桂酰胺?
The molecular weight of α,β-二甲基-N-(2-丙炔基)肉桂酰胺 is 213.12 g/mol.
Where can I buy α,β-二甲基-N-(2-丙炔基)肉桂酰胺?
You can request a quote for α,β-二甲基-N-(2-丙炔基)肉桂酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for α,β-二甲基-N-(2-丙炔基)肉桂酰胺?
Yes, KEHONG BIO provides custom synthesis services for α,β-二甲基-N-(2-丙炔基)肉桂酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.