(2E)-3-phenyl-N-prop-2-ynylprop-2-enamide
TL;DR: (2E)-3-phenyl-N-prop-2-ynylprop-2-enamide (CAS 245342-59-0) is a chemical compound with molecular formula C12H11NO and molecular weight 185.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-phenyl-N-prop-2-ynylprop-2-enamide
Also Known As: N-Propargylcinnamamide, N-Propargyl-trans-cinnamamide, N-(2-Propyne-1-yl)cinnamamide, 3-phenyl-N-prop-2-ynyl-prop-2-enamide, (2E)-3-phenyl-N-(prop-2-yn-1-yl)acrylamide
| Molecular Formula | C12H11NO |
|---|---|
| Molecular Weight | 185.08 g/mol |
| LogP | 1.4492 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 185.08406 |
| Heavy Atoms | 14 |
| Complexity | 359.65817 |
Chemical Identifiers
| CAS Number | 245342-59-0 |
|---|---|
| SMILES | C#CCNC(=O)/C=C/C1=CC=CC=C1 |
Product Overview
(2E)-3-phenyl-N-prop-2-ynylprop-2-enamide (CAS 245342-59-0), with molecular formula C12H11NO and molecular weight 185.08 g/mol. IUPAC: (E)-3-phenyl-N-prop-2-ynylprop-2-enamide.
Chemical Property Profile of (2E)-3-phenyl-N-prop-2-ynylprop-2-enamide
Property Insights of (2E)-3-phenyl-N-prop-2-ynylprop-2-enamide
The XLogP value of 1.4492 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-3-phenyl-N-prop-2-ynylprop-2-enamide. With a topological polar surface area (TPSA) of 29.1 Ų, (2E)-3-phenyl-N-prop-2-ynylprop-2-enamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-3-phenyl-N-prop-2-ynylprop-2-enamide 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 (2E)-3-phenyl-N-prop-2-ynylprop-2-enamide?
The CAS number of (2E)-3-phenyl-N-prop-2-ynylprop-2-enamide is 245342-59-0.
What is the molecular formula of (2E)-3-phenyl-N-prop-2-ynylprop-2-enamide?
The molecular formula of (2E)-3-phenyl-N-prop-2-ynylprop-2-enamide is C12H11NO.
What is the molecular weight of (2E)-3-phenyl-N-prop-2-ynylprop-2-enamide?
The molecular weight of (2E)-3-phenyl-N-prop-2-ynylprop-2-enamide is 185.08 g/mol.
Where can I buy (2E)-3-phenyl-N-prop-2-ynylprop-2-enamide?
You can request a quote for (2E)-3-phenyl-N-prop-2-ynylprop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-3-phenyl-N-prop-2-ynylprop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-3-phenyl-N-prop-2-ynylprop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.