N,N-dimethyl-1-phenylhex-5-en-1-yn-3-amine
TL;DR: N,N-dimethyl-1-phenylhex-5-en-1-yn-3-amine (CAS 5973-45-5) is a chemical compound with molecular formula C14H17N and molecular weight 199.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-1-phenylhex-5-en-1-yn-3-amine
Also Known As: N,N-dimethyl-1-phenylhex-5-en-1-yn-3-amine, Dimethyl-(1-phenylethynyl-but-3-enyl)-amine, BAS 00911337, N,N-dimethyl-1-allyl-3-phenylprop-2-yn-1-amine
| Molecular Formula | C14H17N |
|---|---|
| Molecular Weight | 199.14 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 199.1361 |
| Heavy Atoms | 15 |
| Complexity | 247.0 |
Chemical Identifiers
| CAS Number | 5973-45-5 |
|---|---|
| SMILES | CN(C)C(CC=C)C#CC1=CC=CC=C1 |
| InChIKey | JNNCNNLHVBNIMH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N-dimethyl-1-phenylhex-5-en-1-yn-3-amine (CAS 5973-45-5), with molecular formula C14H17N and molecular weight 199.14 g/mol. IUPAC: N,N-dimethyl-1-phenylhex-5-en-1-yn-3-amine.
Chemical Property Profile of N,N-dimethyl-1-phenylhex-5-en-1-yn-3-amine
Property Insights of N,N-dimethyl-1-phenylhex-5-en-1-yn-3-amine
The XLogP value of 3.3 indicates that N,N-dimethyl-1-phenylhex-5-en-1-yn-3-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, N,N-dimethyl-1-phenylhex-5-en-1-yn-3-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-dimethyl-1-phenylhex-5-en-1-yn-3-amine has 0 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,N-dimethyl-1-phenylhex-5-en-1-yn-3-amine?
The CAS number of N,N-dimethyl-1-phenylhex-5-en-1-yn-3-amine is 5973-45-5.
What is the molecular formula of N,N-dimethyl-1-phenylhex-5-en-1-yn-3-amine?
The molecular formula of N,N-dimethyl-1-phenylhex-5-en-1-yn-3-amine is C14H17N.
What is the molecular weight of N,N-dimethyl-1-phenylhex-5-en-1-yn-3-amine?
The molecular weight of N,N-dimethyl-1-phenylhex-5-en-1-yn-3-amine is 199.14 g/mol.
Where can I buy N,N-dimethyl-1-phenylhex-5-en-1-yn-3-amine?
You can request a quote for N,N-dimethyl-1-phenylhex-5-en-1-yn-3-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-dimethyl-1-phenylhex-5-en-1-yn-3-amine?
Yes, KEHONG BIO provides custom synthesis services for N,N-dimethyl-1-phenylhex-5-en-1-yn-3-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.