2-(4-isopentyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)ethanamine
TL;DR: 2-(4-isopentyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)ethanamine (CAS 858751-49-2) is a chemical compound with molecular formula C14H29NO and molecular weight 227.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2,2-dimethyl-4-(3-methylbutyl)oxan-4-yl]ethanamine
Also Known As: 2-[2,2-dimethyl-4-(3-methylbutyl)oxan-4-yl]ethanamine, 2-(4-isopentyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)ethanamine, 2-[2,2-dimethyl-4-(3-methylbutyl)tetrahydro-2H-pyran-4-yl]ethanamine
| Molecular Formula | C14H29NO |
|---|---|
| Molecular Weight | 227.22 g/mol |
| LogP | 3.3468 |
| Topological Polar Surface Area | 35.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 227.22491 |
| Heavy Atoms | 16 |
| Complexity | 208.78088 |
Chemical Identifiers
| CAS Number | 858751-49-2 |
|---|---|
| SMILES | CC(C)CCC1(CCOC(C1)(C)C)CCN |
Product Overview
2-(4-isopentyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)ethanamine (CAS 858751-49-2), with molecular formula C14H29NO and molecular weight 227.22 g/mol. IUPAC: 2-[2,2-dimethyl-4-(3-methylbutyl)oxan-4-yl]ethanamine.
Chemical Property Profile of 2-(4-isopentyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)ethanamine
Property Insights of 2-(4-isopentyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)ethanamine
The XLogP value of 3.3468 indicates that 2-(4-isopentyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)ethanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.25 Ų, 2-(4-isopentyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-isopentyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)ethanamine 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 2-(4-isopentyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)ethanamine?
The CAS number of 2-(4-isopentyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)ethanamine is 858751-49-2.
What is the molecular formula of 2-(4-isopentyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)ethanamine?
The molecular formula of 2-(4-isopentyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)ethanamine is C14H29NO.
What is the molecular weight of 2-(4-isopentyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)ethanamine?
The molecular weight of 2-(4-isopentyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)ethanamine is 227.22 g/mol.
Where can I buy 2-(4-isopentyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)ethanamine?
You can request a quote for 2-(4-isopentyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-isopentyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)ethanamine?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-isopentyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.