N-(Adamantan-1-yl)-3-(trimethylazaniumyl)propanimidate--hydrogen iodide (1/1)
TL;DR: N-(Adamantan-1-yl)-3-(trimethylazaniumyl)propanimidate--hydrogen iodide (1/1) (CAS 25517-14-0) is a chemical compound with molecular formula C16H29IN2O and molecular weight 392.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(1-adamantylamino)-3-oxopropyl]-trimethylazanium iodide
Also Known As: (2-(1-Adamantylcarbamoyl)ethyl)trimethylammonium iodide, Ammonium, (2-(1-adamantylcarbamoyl)ethyl)trimethyl-, iodide, [3-(1-adamantylamino)-3-oxopropyl]-trimethylazanium iodide, N-(Adamantan-1-yl)-3-(trimethylazaniumyl)propanimidate--hydrogen iodide (1/1), RefChem:1091390
| Molecular Formula | C16H29IN2O |
|---|---|
| Molecular Weight | 392.13 g/mol |
| LogP | -0.83 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 392.13245 |
| Heavy Atoms | 20 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 25517-14-0 |
|---|---|
| SMILES | C[N+](C)(C)CCC(=O)NC12CC3CC(C1)CC(C3)C2.[I-] |
| InChIKey | NMIUEQPHSGCWDJ-UHFFFAOYSA-N |
Product Overview
N-(Adamantan-1-yl)-3-(trimethylazaniumyl)propanimidate--hydrogen iodide (1/1) (CAS 25517-14-0), with molecular formula C16H29IN2O and molecular weight 392.13 g/mol. IUPAC: [3-(1-adamantylamino)-3-oxopropyl]-trimethylazanium iodide.
Chemical Property Profile of N-(Adamantan-1-yl)-3-(trimethylazaniumyl)propanimidate--hydrogen iodide (1/1)
Property Insights of N-(Adamantan-1-yl)-3-(trimethylazaniumyl)propanimidate--hydrogen iodide (1/1)
The XLogP value of -0.83 indicates that N-(Adamantan-1-yl)-3-(trimethylazaniumyl)propanimidate--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-(Adamantan-1-yl)-3-(trimethylazaniumyl)propanimidate--hydrogen iodide (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(Adamantan-1-yl)-3-(trimethylazaniumyl)propanimidate--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-(Adamantan-1-yl)-3-(trimethylazaniumyl)propanimidate--hydrogen iodide (1/1)?
The CAS number of N-(Adamantan-1-yl)-3-(trimethylazaniumyl)propanimidate--hydrogen iodide (1/1) is 25517-14-0.
What is the molecular formula of N-(Adamantan-1-yl)-3-(trimethylazaniumyl)propanimidate--hydrogen iodide (1/1)?
The molecular formula of N-(Adamantan-1-yl)-3-(trimethylazaniumyl)propanimidate--hydrogen iodide (1/1) is C16H29IN2O.
What is the molecular weight of N-(Adamantan-1-yl)-3-(trimethylazaniumyl)propanimidate--hydrogen iodide (1/1)?
The molecular weight of N-(Adamantan-1-yl)-3-(trimethylazaniumyl)propanimidate--hydrogen iodide (1/1) is 392.13 g/mol.
Where can I buy N-(Adamantan-1-yl)-3-(trimethylazaniumyl)propanimidate--hydrogen iodide (1/1)?
You can request a quote for N-(Adamantan-1-yl)-3-(trimethylazaniumyl)propanimidate--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-(Adamantan-1-yl)-3-(trimethylazaniumyl)propanimidate--hydrogen iodide (1/1)?
Yes, KEHONG BIO provides custom synthesis services for N-(Adamantan-1-yl)-3-(trimethylazaniumyl)propanimidate--hydrogen iodide (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.