N-(1-phenylpropyl)butan-1-amine
TL;DR: N-(1-phenylpropyl)butan-1-amine (CAS 92111-07-4) is a chemical compound with molecular formula C13H21N and molecular weight 191.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-phenylpropyl)butan-1-amine
Also Known As: butyl(1-phenylpropyl)amine, N-(1-phenylpropyl)butan-1-amine, Butyl(alpha-ethylbenzyl)amine, alpha-Ethyl-N-butylbenzenemethanamine, 4-phenyl-5-piperidin-1-yl-2,4-dihydro-[1,2,4]triazole-3-thione
| Molecular Formula | C13H21N |
|---|---|
| Molecular Weight | 191.17 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 191.1674 |
| Heavy Atoms | 14 |
| Complexity | 127.0 |
Chemical Identifiers
| CAS Number | 92111-07-4 |
|---|---|
| SMILES | CCCCNC(CC)C1=CC=CC=C1 |
| InChIKey | BQNBGUDSGSWTRR-UHFFFAOYSA-N |
Product Overview
N-(1-phenylpropyl)butan-1-amine (CAS 92111-07-4), with molecular formula C13H21N and molecular weight 191.17 g/mol. IUPAC: N-(1-phenylpropyl)butan-1-amine.
Chemical Property Profile of N-(1-phenylpropyl)butan-1-amine
Property Insights of N-(1-phenylpropyl)butan-1-amine
The XLogP value of 3.5 indicates that N-(1-phenylpropyl)butan-1-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-(1-phenylpropyl)butan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1-phenylpropyl)butan-1-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-(1-phenylpropyl)butan-1-amine?
The CAS number of N-(1-phenylpropyl)butan-1-amine is 92111-07-4.
What is the molecular formula of N-(1-phenylpropyl)butan-1-amine?
The molecular formula of N-(1-phenylpropyl)butan-1-amine is C13H21N.
What is the molecular weight of N-(1-phenylpropyl)butan-1-amine?
The molecular weight of N-(1-phenylpropyl)butan-1-amine is 191.17 g/mol.
Where can I buy N-(1-phenylpropyl)butan-1-amine?
You can request a quote for N-(1-phenylpropyl)butan-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-phenylpropyl)butan-1-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(1-phenylpropyl)butan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.