4-methoxy-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline
TL;DR: 4-methoxy-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline (CAS 67715-18-8) is a chemical compound with molecular formula C12H18N2O and molecular weight 206.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline
Also Known As: 4-methoxy-N-(pyrrolidin-2-ylmethyl)aniline, J2.723.506I, 4-methoxy-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline, (S)-2-(N-(4'-methoxyphenyl)aminomethyl)pyrrolidine, 4-methoxy-N-{[(2S)-pyrrolidin-2-yl]methyl}aniline
| Molecular Formula | C12H18N2O |
|---|---|
| Molecular Weight | 206.14 g/mol |
| LogP | 1.8591 |
| Topological Polar Surface Area | 33.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 206.1419 |
| Heavy Atoms | 15 |
| Complexity | 290.99536 |
Chemical Identifiers
| CAS Number | 67715-18-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC[C@@H]2CCCN2 |
Product Overview
4-methoxy-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline (CAS 67715-18-8), with molecular formula C12H18N2O and molecular weight 206.14 g/mol. IUPAC: 4-methoxy-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline.
Chemical Property Profile of 4-methoxy-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline
Property Insights of 4-methoxy-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline
The XLogP value of 1.8591 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-methoxy-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline. With a topological polar surface area (TPSA) of 33.29 Ų, 4-methoxy-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-methoxy-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline has 2 hydrogen bond donor(s) and 3 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 4-methoxy-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline?
The CAS number of 4-methoxy-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline is 67715-18-8.
What is the molecular formula of 4-methoxy-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline?
The molecular formula of 4-methoxy-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline is C12H18N2O.
What is the molecular weight of 4-methoxy-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline?
The molecular weight of 4-methoxy-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline is 206.14 g/mol.
Where can I buy 4-methoxy-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline?
You can request a quote for 4-methoxy-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methoxy-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline?
Yes, KEHONG BIO provides custom synthesis services for 4-methoxy-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.