1-(1-adamantyl)-N-benzylpropan-2-amine
TL;DR: 1-(1-adamantyl)-N-benzylpropan-2-amine (CAS 56558-44-2) is a chemical compound with molecular formula C20H29N and molecular weight 283.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-adamantyl)-N-benzylpropan-2-amine
Also Known As: 1-(1-adamantyl)-N-benzylpropan-2-amine, 1-(1-adamantyl)-N-benzyl-propan-2-amine, 1-(Adamantan-1-yl)-N-benzylpropan-2-amine
| Molecular Formula | C20H29N |
|---|---|
| Molecular Weight | 283.23 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 283.23 |
| Heavy Atoms | 21 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 56558-44-2 |
|---|---|
| SMILES | CC(CC12CC3CC(C1)CC(C3)C2)NCC4=CC=CC=C4 |
| InChIKey | DTMWDBKFHSFBDO-UHFFFAOYSA-N |
Product Overview
1-(1-adamantyl)-N-benzylpropan-2-amine (CAS 56558-44-2), with molecular formula C20H29N and molecular weight 283.23 g/mol. IUPAC: 1-(1-adamantyl)-N-benzylpropan-2-amine.
Chemical Property Profile of 1-(1-adamantyl)-N-benzylpropan-2-amine
Property Insights of 1-(1-adamantyl)-N-benzylpropan-2-amine
The XLogP value of 5.5 indicates that 1-(1-adamantyl)-N-benzylpropan-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, 1-(1-adamantyl)-N-benzylpropan-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1-adamantyl)-N-benzylpropan-2-amine has 1 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 1-(1-adamantyl)-N-benzylpropan-2-amine?
The CAS number of 1-(1-adamantyl)-N-benzylpropan-2-amine is 56558-44-2.
What is the molecular formula of 1-(1-adamantyl)-N-benzylpropan-2-amine?
The molecular formula of 1-(1-adamantyl)-N-benzylpropan-2-amine is C20H29N.
What is the molecular weight of 1-(1-adamantyl)-N-benzylpropan-2-amine?
The molecular weight of 1-(1-adamantyl)-N-benzylpropan-2-amine is 283.23 g/mol.
Where can I buy 1-(1-adamantyl)-N-benzylpropan-2-amine?
You can request a quote for 1-(1-adamantyl)-N-benzylpropan-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1-adamantyl)-N-benzylpropan-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-adamantyl)-N-benzylpropan-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.