Adamantane, 1-(3-dimethylaminopropyl)-, hydrochloride
TL;DR: Adamantane, 1-(3-dimethylaminopropyl)-, hydrochloride (CAS 31898-05-2) is a chemical compound with molecular formula C15H28ClN and molecular weight 257.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-adamantyl)-N,N-dimethylpropan-1-amine;hydrochloride
Also Known As: ADAMANTANE, 1-(3-DIMETHYLAMINOPROPYL)-, HYDROCHLORIDE, Propylamine, 3-(1-adamantyl)-N,N-dimethyl-, hydrochloride, 3-(1-adamantyl)-N,N-dimethylpropan-1-amine hydrochloride, 1-Adamantanepropylamine, N,N-dimethyl-, hydrochloride, 3-(Adamantan-1-yl)-N,N-dimethylpropan-1-amine--hydrogen chloride (1/1)
| Molecular Formula | C15H28ClN |
|---|---|
| Molecular Weight | 257.19 g/mol |
| LogP | 3.97 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 257.19104 |
| Heavy Atoms | 17 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 31898-05-2 |
|---|---|
| SMILES | CN(C)CCCC12CC3CC(C1)CC(C3)C2.Cl |
| InChIKey | PVSWBRFYDVJIQQ-UHFFFAOYSA-N |
Product Overview
Adamantane, 1-(3-dimethylaminopropyl)-, hydrochloride (CAS 31898-05-2), with molecular formula C15H28ClN and molecular weight 257.19 g/mol. IUPAC: 3-(1-adamantyl)-N,N-dimethylpropan-1-amine;hydrochloride.
Chemical Property Profile of Adamantane, 1-(3-dimethylaminopropyl)-, hydrochloride
Property Insights of Adamantane, 1-(3-dimethylaminopropyl)-, hydrochloride
The XLogP value of 3.97 indicates that Adamantane, 1-(3-dimethylaminopropyl)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, Adamantane, 1-(3-dimethylaminopropyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Adamantane, 1-(3-dimethylaminopropyl)-, hydrochloride 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 Adamantane, 1-(3-dimethylaminopropyl)-, hydrochloride?
The CAS number of Adamantane, 1-(3-dimethylaminopropyl)-, hydrochloride is 31898-05-2.
What is the molecular formula of Adamantane, 1-(3-dimethylaminopropyl)-, hydrochloride?
The molecular formula of Adamantane, 1-(3-dimethylaminopropyl)-, hydrochloride is C15H28ClN.
What is the molecular weight of Adamantane, 1-(3-dimethylaminopropyl)-, hydrochloride?
The molecular weight of Adamantane, 1-(3-dimethylaminopropyl)-, hydrochloride is 257.19 g/mol.
Where can I buy Adamantane, 1-(3-dimethylaminopropyl)-, hydrochloride?
You can request a quote for Adamantane, 1-(3-dimethylaminopropyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Adamantane, 1-(3-dimethylaminopropyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Adamantane, 1-(3-dimethylaminopropyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.