N-(3-methylbenzyl)-2-(pyrrolidin-1-yl)ethanamine
TL;DR: N-(3-methylbenzyl)-2-(pyrrolidin-1-yl)ethanamine (CAS 827326-53-4) is a chemical compound with molecular formula C14H22N2 and molecular weight 218.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-methylphenyl)methyl]-2-pyrrolidin-1-ylethanamine
Also Known As: N-(3-methylbenzyl)-2-(pyrrolidin-1-yl)ethanamine, N-[(3-methylphenyl)methyl]-2-pyrrolidin-1-ylethanamine, 1-Pyrrolidineethanamine,N-[(3-methylphenyl)methyl]-(9CI), N-[(3-methylphenyl)methyl]-2-pyrrolidin-1-yl-ethanamine, 1-Pyrrolidineethanamine, N-[(3-methylphenyl)methyl]- (9CI)
| Molecular Formula | C14H22N2 |
|---|---|
| Molecular Weight | 218.18 g/mol |
| LogP | 2.18042 |
| Topological Polar Surface Area | 15.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 218.1783 |
| Heavy Atoms | 16 |
| Complexity | 316.2663 |
Chemical Identifiers
| CAS Number | 827326-53-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)CNCCN2CCCC2 |
Product Overview
N-(3-methylbenzyl)-2-(pyrrolidin-1-yl)ethanamine (CAS 827326-53-4), with molecular formula C14H22N2 and molecular weight 218.18 g/mol. IUPAC: N-[(3-methylphenyl)methyl]-2-pyrrolidin-1-ylethanamine.
Chemical Property Profile of N-(3-methylbenzyl)-2-(pyrrolidin-1-yl)ethanamine
Property Insights of N-(3-methylbenzyl)-2-(pyrrolidin-1-yl)ethanamine
The XLogP value of 2.18042 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-methylbenzyl)-2-(pyrrolidin-1-yl)ethanamine. With a topological polar surface area (TPSA) of 15.27 Ų, N-(3-methylbenzyl)-2-(pyrrolidin-1-yl)ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-methylbenzyl)-2-(pyrrolidin-1-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 N-(3-methylbenzyl)-2-(pyrrolidin-1-yl)ethanamine?
The CAS number of N-(3-methylbenzyl)-2-(pyrrolidin-1-yl)ethanamine is 827326-53-4.
What is the molecular formula of N-(3-methylbenzyl)-2-(pyrrolidin-1-yl)ethanamine?
The molecular formula of N-(3-methylbenzyl)-2-(pyrrolidin-1-yl)ethanamine is C14H22N2.
What is the molecular weight of N-(3-methylbenzyl)-2-(pyrrolidin-1-yl)ethanamine?
The molecular weight of N-(3-methylbenzyl)-2-(pyrrolidin-1-yl)ethanamine is 218.18 g/mol.
Where can I buy N-(3-methylbenzyl)-2-(pyrrolidin-1-yl)ethanamine?
You can request a quote for N-(3-methylbenzyl)-2-(pyrrolidin-1-yl)ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-methylbenzyl)-2-(pyrrolidin-1-yl)ethanamine?
Yes, KEHONG BIO provides custom synthesis services for N-(3-methylbenzyl)-2-(pyrrolidin-1-yl)ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.