n-Benzyl-2,4,4-trimethylpentan-2-amine
TL;DR: n-Benzyl-2,4,4-trimethylpentan-2-amine (CAS 40207-03-2) is a chemical compound with molecular formula C15H25N and molecular weight 219.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-2,4,4-trimethylpentan-2-amine
Also Known As: n-benzyl-2,4,4-trimethylpentan-2-amine, 1,1,3,3-Tetramethylbutylbenzylamine, N-benzyl-2,4,4-trimethyl-2-pentanamine, N-Benzyl-2,4,4-trimethylpentane-2-amine, J1.346.655F
| Molecular Formula | C15H25N |
|---|---|
| Molecular Weight | 219.20 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 219.1987 |
| Heavy Atoms | 16 |
| Complexity | 194.0 |
Chemical Identifiers
| CAS Number | 40207-03-2 |
|---|---|
| SMILES | CC(C)(C)CC(C)(C)NCC1=CC=CC=C1 |
| InChIKey | SRNCZQHDQZRJHU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
n-Benzyl-2,4,4-trimethylpentan-2-amine (CAS 40207-03-2), with molecular formula C15H25N and molecular weight 219.20 g/mol. IUPAC: N-benzyl-2,4,4-trimethylpentan-2-amine.
Chemical Property Profile of n-Benzyl-2,4,4-trimethylpentan-2-amine
Property Insights of n-Benzyl-2,4,4-trimethylpentan-2-amine
The XLogP value of 4.0 indicates that n-Benzyl-2,4,4-trimethylpentan-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, n-Benzyl-2,4,4-trimethylpentan-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n-Benzyl-2,4,4-trimethylpentan-2-amine 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 n-Benzyl-2,4,4-trimethylpentan-2-amine?
The CAS number of n-Benzyl-2,4,4-trimethylpentan-2-amine is 40207-03-2.
What is the molecular formula of n-Benzyl-2,4,4-trimethylpentan-2-amine?
The molecular formula of n-Benzyl-2,4,4-trimethylpentan-2-amine is C15H25N.
What is the molecular weight of n-Benzyl-2,4,4-trimethylpentan-2-amine?
The molecular weight of n-Benzyl-2,4,4-trimethylpentan-2-amine is 219.20 g/mol.
Where can I buy n-Benzyl-2,4,4-trimethylpentan-2-amine?
You can request a quote for n-Benzyl-2,4,4-trimethylpentan-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-Benzyl-2,4,4-trimethylpentan-2-amine?
Yes, KEHONG BIO provides custom synthesis services for n-Benzyl-2,4,4-trimethylpentan-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.