N-(2,2,3,3,3-Pentafluoropropylidene)-1-adamantanamine
TL;DR: N-(2,2,3,3,3-Pentafluoropropylidene)-1-adamantanamine (CAS 31224-44-9) is a chemical compound with molecular formula C13H16F5N and molecular weight 281.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-adamantyl)-2,2,3,3,3-pentafluoropropan-1-imine
Also Known As: 2,6-Dimethyl-1,6-octadien, N-(2,2,3,3,3-Pentafluoropropylidene)-1-adamantanamine, 1-Adamantanamine, N-(2,2,3,3,3-pentafluoropropylidene)-, N-(1-adamantyl)-2,2,3,3,3-pentafluoropropan-1-imine, Tricyclo[3.3.1.13,7]decan-1-amine,N-(2,2,3,3,3-pentafluoropropylidene)-
| Molecular Formula | C13H16F5N |
|---|---|
| Molecular Weight | 281.12 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 12.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 281.1203 |
| Heavy Atoms | 19 |
| Complexity | 357.0 |
Chemical Identifiers
| CAS Number | 31224-44-9 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)N=CC(C(F)(F)F)(F)F |
| InChIKey | RYDMYGVDLQMMCE-UHFFFAOYSA-N |
Product Overview
N-(2,2,3,3,3-Pentafluoropropylidene)-1-adamantanamine (CAS 31224-44-9), with molecular formula C13H16F5N and molecular weight 281.12 g/mol. IUPAC: N-(1-adamantyl)-2,2,3,3,3-pentafluoropropan-1-imine.
Chemical Property Profile of N-(2,2,3,3,3-Pentafluoropropylidene)-1-adamantanamine
Property Insights of N-(2,2,3,3,3-Pentafluoropropylidene)-1-adamantanamine
The XLogP value of 4.3 indicates that N-(2,2,3,3,3-Pentafluoropropylidene)-1-adamantanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.4 Ų, N-(2,2,3,3,3-Pentafluoropropylidene)-1-adamantanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2,2,3,3,3-Pentafluoropropylidene)-1-adamantanamine has 0 hydrogen bond donor(s) and 6 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-(2,2,3,3,3-Pentafluoropropylidene)-1-adamantanamine?
The CAS number of N-(2,2,3,3,3-Pentafluoropropylidene)-1-adamantanamine is 31224-44-9.
What is the molecular formula of N-(2,2,3,3,3-Pentafluoropropylidene)-1-adamantanamine?
The molecular formula of N-(2,2,3,3,3-Pentafluoropropylidene)-1-adamantanamine is C13H16F5N.
What is the molecular weight of N-(2,2,3,3,3-Pentafluoropropylidene)-1-adamantanamine?
The molecular weight of N-(2,2,3,3,3-Pentafluoropropylidene)-1-adamantanamine is 281.12 g/mol.
Where can I buy N-(2,2,3,3,3-Pentafluoropropylidene)-1-adamantanamine?
You can request a quote for N-(2,2,3,3,3-Pentafluoropropylidene)-1-adamantanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,2,3,3,3-Pentafluoropropylidene)-1-adamantanamine?
Yes, KEHONG BIO provides custom synthesis services for N-(2,2,3,3,3-Pentafluoropropylidene)-1-adamantanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.