Benzeneethanamine, N-methyl-N-2-propynyl-
TL;DR: Benzeneethanamine, N-methyl-N-2-propynyl- (CAS 2322-02-3) is a chemical compound with molecular formula C12H15N and molecular weight 173.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-N-(2-phenylethyl)prop-2-yn-1-amine
Also Known As: MPPE, Benzeneethanamine, N-methyl-N-2-propynyl-, N-Phenethyl-N-methylpropargylamine, N-Methyl-N-(2-propynyl)phenethylamine, N-Methyl-N-propargyl-2-phenylethanamine
| Molecular Formula | C12H15N |
|---|---|
| Molecular Weight | 173.12 g/mol |
| LogP | 1.7941 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 173.12045 |
| Heavy Atoms | 13 |
| Complexity | 270.926 |
Chemical Identifiers
| CAS Number | 2322-02-3 |
|---|---|
| SMILES | CN(CCC1=CC=CC=C1)CC#C |
Product Overview
Benzeneethanamine, N-methyl-N-2-propynyl- (CAS 2322-02-3), with molecular formula C12H15N and molecular weight 173.12 g/mol. IUPAC: N-methyl-N-(2-phenylethyl)prop-2-yn-1-amine.
Chemical Property Profile of Benzeneethanamine, N-methyl-N-2-propynyl-
Property Insights of Benzeneethanamine, N-methyl-N-2-propynyl-
The XLogP value of 1.7941 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzeneethanamine, N-methyl-N-2-propynyl-. With a topological polar surface area (TPSA) of 3.24 Ų, Benzeneethanamine, N-methyl-N-2-propynyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzeneethanamine, N-methyl-N-2-propynyl- 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 Benzeneethanamine, N-methyl-N-2-propynyl-?
The CAS number of Benzeneethanamine, N-methyl-N-2-propynyl- is 2322-02-3.
What is the molecular formula of Benzeneethanamine, N-methyl-N-2-propynyl-?
The molecular formula of Benzeneethanamine, N-methyl-N-2-propynyl- is C12H15N.
What is the molecular weight of Benzeneethanamine, N-methyl-N-2-propynyl-?
The molecular weight of Benzeneethanamine, N-methyl-N-2-propynyl- is 173.12 g/mol.
Where can I buy Benzeneethanamine, N-methyl-N-2-propynyl-?
You can request a quote for Benzeneethanamine, N-methyl-N-2-propynyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneethanamine, N-methyl-N-2-propynyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzeneethanamine, N-methyl-N-2-propynyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.