(E)-N-methyl-5-(1-oxidopyridin-1-ium-3-yl)pent-4-en-2-amine
TL;DR: (E)-N-methyl-5-(1-oxidopyridin-1-ium-3-yl)pent-4-en-2-amine (CAS 312728-44-2) is a chemical compound with molecular formula C11H16N2O and molecular weight 192.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-methyl-5-(1-oxidopyridin-1-ium-3-yl)pent-4-en-2-amine
Also Known As: (4E)-N-methyl-5-(1-oxo-pyridin-3-yl)-4-penten-2-amine, (E)-N-methyl-5-(1-oxidopyridin-5-yl)pent-4-en-2-amine
| Molecular Formula | C11H16N2O |
|---|---|
| Molecular Weight | 192.13 g/mol |
| LogP | 1.3312 |
| Topological Polar Surface Area | 38.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 192.12627 |
| Heavy Atoms | 14 |
| Complexity | 309.91077 |
Chemical Identifiers
| CAS Number | 312728-44-2 |
|---|---|
| SMILES | CC(C/C=C/C1=C[N+](=CC=C1)[O-])NC |
Product Overview
(E)-N-methyl-5-(1-oxidopyridin-1-ium-3-yl)pent-4-en-2-amine (CAS 312728-44-2), with molecular formula C11H16N2O and molecular weight 192.13 g/mol. IUPAC: (E)-N-methyl-5-(1-oxidopyridin-1-ium-3-yl)pent-4-en-2-amine.
Chemical Property Profile of (E)-N-methyl-5-(1-oxidopyridin-1-ium-3-yl)pent-4-en-2-amine
Property Insights of (E)-N-methyl-5-(1-oxidopyridin-1-ium-3-yl)pent-4-en-2-amine
The XLogP value of 1.3312 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-N-methyl-5-(1-oxidopyridin-1-ium-3-yl)pent-4-en-2-amine. With a topological polar surface area (TPSA) of 38.97 Ų, (E)-N-methyl-5-(1-oxidopyridin-1-ium-3-yl)pent-4-en-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-N-methyl-5-(1-oxidopyridin-1-ium-3-yl)pent-4-en-2-amine has 1 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 (E)-N-methyl-5-(1-oxidopyridin-1-ium-3-yl)pent-4-en-2-amine?
The CAS number of (E)-N-methyl-5-(1-oxidopyridin-1-ium-3-yl)pent-4-en-2-amine is 312728-44-2.
What is the molecular formula of (E)-N-methyl-5-(1-oxidopyridin-1-ium-3-yl)pent-4-en-2-amine?
The molecular formula of (E)-N-methyl-5-(1-oxidopyridin-1-ium-3-yl)pent-4-en-2-amine is C11H16N2O.
What is the molecular weight of (E)-N-methyl-5-(1-oxidopyridin-1-ium-3-yl)pent-4-en-2-amine?
The molecular weight of (E)-N-methyl-5-(1-oxidopyridin-1-ium-3-yl)pent-4-en-2-amine is 192.13 g/mol.
Where can I buy (E)-N-methyl-5-(1-oxidopyridin-1-ium-3-yl)pent-4-en-2-amine?
You can request a quote for (E)-N-methyl-5-(1-oxidopyridin-1-ium-3-yl)pent-4-en-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-methyl-5-(1-oxidopyridin-1-ium-3-yl)pent-4-en-2-amine?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-methyl-5-(1-oxidopyridin-1-ium-3-yl)pent-4-en-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.