![Trimethyl-[3-(prop-2-enoylamino)propyl]azanium structure](/static/products/4502/45021-76-9.webp)
Trimethyl-[3-(prop-2-enoylamino)propyl]azanium
TL;DR: Trimethyl-[3-(prop-2-enoylamino)propyl]azanium (CAS 45021-76-9) is a chemical compound with molecular formula C9H19N2O+ and molecular weight 171.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-[3-(prop-2-enoylamino)propyl]azanium
Also Known As: 3-acrylamidopropyl trimethylammonium, Trimethyl-[3-(prop-2-enoylamino)propyl]azanium, 3-(Acryloylamino)propyltrimethylaminium, N,N,N-Trimethyl-3-(prop-2-enamido)propan-1-aminium, 1-Propanaminium, N,N,N-trimethyl-3-[(1-oxo-2-propenyl)amino]-
| Molecular Formula | C9H19N2O+ |
|---|---|
| Molecular Weight | 171.15 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 171.14973 |
| Heavy Atoms | 12 |
| Complexity | 158.0 |
Chemical Identifiers
| CAS Number | 45021-76-9 |
|---|---|
| SMILES | C[N+](C)(C)CCCNC(=O)C=C |
| InChIKey | RUACIFFMSHZUKZ-UHFFFAOYSA-O |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Trimethyl-[3-(prop-2-enoylamino)propyl]azanium (CAS 45021-76-9), with molecular formula C9H19N2O+ and molecular weight 171.15 g/mol. IUPAC: trimethyl-[3-(prop-2-enoylamino)propyl]azanium.
Chemical Property Profile of Trimethyl-[3-(prop-2-enoylamino)propyl]azanium
Property Insights of Trimethyl-[3-(prop-2-enoylamino)propyl]azanium
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trimethyl-[3-(prop-2-enoylamino)propyl]azanium. With a topological polar surface area (TPSA) of 29.1 Ų, Trimethyl-[3-(prop-2-enoylamino)propyl]azanium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Trimethyl-[3-(prop-2-enoylamino)propyl]azanium 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 Trimethyl-[3-(prop-2-enoylamino)propyl]azanium?
The CAS number of Trimethyl-[3-(prop-2-enoylamino)propyl]azanium is 45021-76-9.
What is the molecular formula of Trimethyl-[3-(prop-2-enoylamino)propyl]azanium?
The molecular formula of Trimethyl-[3-(prop-2-enoylamino)propyl]azanium is C9H19N2O+.
What is the molecular weight of Trimethyl-[3-(prop-2-enoylamino)propyl]azanium?
The molecular weight of Trimethyl-[3-(prop-2-enoylamino)propyl]azanium is 171.15 g/mol.
Where can I buy Trimethyl-[3-(prop-2-enoylamino)propyl]azanium?
You can request a quote for Trimethyl-[3-(prop-2-enoylamino)propyl]azanium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trimethyl-[3-(prop-2-enoylamino)propyl]azanium?
Yes, KEHONG BIO provides custom synthesis services for Trimethyl-[3-(prop-2-enoylamino)propyl]azanium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.