Adamantane, 1-(2-benzylaminopropyl)-, hydrochloride
TL;DR: Adamantane, 1-(2-benzylaminopropyl)-, hydrochloride (CAS 31897-90-2) is a chemical compound with molecular formula C20H30ClN and molecular weight 319.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-adamantyl)-N-benzylpropan-1-amine;hydrochloride
Also Known As: ADAMANTANE, 1-(2-BENZYLAMINOPROPYL)-, HYDROCHLORIDE, 2-Propylamine, 1-(1-adamantyl)-N-benzyl-, hydrochloride, 3-(1-adamantyl)-N-benzylpropan-1-amine hydrochloride, 1-Adamantaneethylamine, N-benzyl-.alpha.-methyl-, hydrochloride, 3-(Adamantan-1-yl)-N-benzylpropan-1-amine--hydrogen chloride (1/1)
| Molecular Formula | C20H30ClN |
|---|---|
| Molecular Weight | 319.21 g/mol |
| LogP | 5.19 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 319.20667 |
| Heavy Atoms | 22 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 31897-90-2 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)CCCNCC4=CC=CC=C4.Cl |
| InChIKey | PYCJDIVWRGIZJB-UHFFFAOYSA-N |
Product Overview
Adamantane, 1-(2-benzylaminopropyl)-, hydrochloride (CAS 31897-90-2), with molecular formula C20H30ClN and molecular weight 319.21 g/mol. IUPAC: 3-(1-adamantyl)-N-benzylpropan-1-amine;hydrochloride.
Chemical Property Profile of Adamantane, 1-(2-benzylaminopropyl)-, hydrochloride
Property Insights of Adamantane, 1-(2-benzylaminopropyl)-, hydrochloride
The XLogP value of 5.19 indicates that Adamantane, 1-(2-benzylaminopropyl)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, Adamantane, 1-(2-benzylaminopropyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Adamantane, 1-(2-benzylaminopropyl)-, hydrochloride has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Adamantane, 1-(2-benzylaminopropyl)-, hydrochloride?
The CAS number of Adamantane, 1-(2-benzylaminopropyl)-, hydrochloride is 31897-90-2.
What is the molecular formula of Adamantane, 1-(2-benzylaminopropyl)-, hydrochloride?
The molecular formula of Adamantane, 1-(2-benzylaminopropyl)-, hydrochloride is C20H30ClN.
What is the molecular weight of Adamantane, 1-(2-benzylaminopropyl)-, hydrochloride?
The molecular weight of Adamantane, 1-(2-benzylaminopropyl)-, hydrochloride is 319.21 g/mol.
Where can I buy Adamantane, 1-(2-benzylaminopropyl)-, hydrochloride?
You can request a quote for Adamantane, 1-(2-benzylaminopropyl)-, 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-(2-benzylaminopropyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Adamantane, 1-(2-benzylaminopropyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.