N-Methyl-4-(trimethylazaniumyl)butanimidate--hydrogen iodide (1/1)
TL;DR: N-Methyl-4-(trimethylazaniumyl)butanimidate--hydrogen iodide (1/1) (CAS 64037-72-5) is a chemical compound with molecular formula C8H19IN2O and molecular weight 286.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-[4-(methylamino)-4-oxobutyl]azanium iodide
Also Known As: N-Methyl-4-(trimethylammonio)butyramide iodide, trimethyl-[3-(methylcarbamoyl)propyl]azanium iodide, BUTYRAMIDE, N-METHYL-4-(TRIMETHYLAMMONIO)-, IODIDE, trimethyl-[4-(methylamino)-4-oxobutyl]azanium iodide, 1-Butanaminium, N,N,N-trimethyl-4-(methylamino)-4-oxo-, iodide
| Molecular Formula | C8H19IN2O |
|---|---|
| Molecular Weight | 286.05 g/mol |
| LogP | -2.78 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 286.0542 |
| Heavy Atoms | 12 |
| Complexity | 127.0 |
Chemical Identifiers
| CAS Number | 64037-72-5 |
|---|---|
| SMILES | CNC(=O)CCC[N+](C)(C)C.[I-] |
| InChIKey | CZQCCVHVWYIKDO-UHFFFAOYSA-N |
Product Overview
N-Methyl-4-(trimethylazaniumyl)butanimidate--hydrogen iodide (1/1) (CAS 64037-72-5), with molecular formula C8H19IN2O and molecular weight 286.05 g/mol. IUPAC: trimethyl-[4-(methylamino)-4-oxobutyl]azanium iodide.
Chemical Property Profile of N-Methyl-4-(trimethylazaniumyl)butanimidate--hydrogen iodide (1/1)
Property Insights of N-Methyl-4-(trimethylazaniumyl)butanimidate--hydrogen iodide (1/1)
The XLogP value of -2.78 indicates that N-Methyl-4-(trimethylazaniumyl)butanimidate--hydrogen iodide (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 29.1 Ų, N-Methyl-4-(trimethylazaniumyl)butanimidate--hydrogen iodide (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Methyl-4-(trimethylazaniumyl)butanimidate--hydrogen iodide (1/1) 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 N-Methyl-4-(trimethylazaniumyl)butanimidate--hydrogen iodide (1/1)?
The CAS number of N-Methyl-4-(trimethylazaniumyl)butanimidate--hydrogen iodide (1/1) is 64037-72-5.
What is the molecular formula of N-Methyl-4-(trimethylazaniumyl)butanimidate--hydrogen iodide (1/1)?
The molecular formula of N-Methyl-4-(trimethylazaniumyl)butanimidate--hydrogen iodide (1/1) is C8H19IN2O.
What is the molecular weight of N-Methyl-4-(trimethylazaniumyl)butanimidate--hydrogen iodide (1/1)?
The molecular weight of N-Methyl-4-(trimethylazaniumyl)butanimidate--hydrogen iodide (1/1) is 286.05 g/mol.
Where can I buy N-Methyl-4-(trimethylazaniumyl)butanimidate--hydrogen iodide (1/1)?
You can request a quote for N-Methyl-4-(trimethylazaniumyl)butanimidate--hydrogen iodide (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methyl-4-(trimethylazaniumyl)butanimidate--hydrogen iodide (1/1)?
Yes, KEHONG BIO provides custom synthesis services for N-Methyl-4-(trimethylazaniumyl)butanimidate--hydrogen iodide (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.