Pyrrolidinylmethylindole
TL;DR: Pyrrolidinylmethylindole (CAS 46421-52-7) is a chemical compound with molecular formula C13H16N2 and molecular weight 200.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(pyrrolidin-1-ylmethyl)-1H-indole
Also Known As: pyrrolidinylmethylindole, 2-(pyrrolidin-1-ylmethyl)-1H-indole, 2-(1-pyrrolidinylmethyl)-1H-Indole
| Molecular Formula | C13H16N2 |
|---|---|
| Molecular Weight | 200.13 g/mol |
| LogP | 2.7637 |
| Topological Polar Surface Area | 19.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 200.13135 |
| Heavy Atoms | 15 |
| Complexity | 419.25882 |
Chemical Identifiers
| CAS Number | 46421-52-7 |
|---|---|
| SMILES | C1CCN(C1)CC2=CC3=CC=CC=C3N2 |
Product Overview
Pyrrolidinylmethylindole (CAS 46421-52-7), with molecular formula C13H16N2 and molecular weight 200.13 g/mol. IUPAC: 2-(pyrrolidin-1-ylmethyl)-1H-indole.
Chemical Property Profile of Pyrrolidinylmethylindole
Property Insights of Pyrrolidinylmethylindole
The XLogP value of 2.7637 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrrolidinylmethylindole. With a topological polar surface area (TPSA) of 19.03 Ų, Pyrrolidinylmethylindole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolidinylmethylindole 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 Pyrrolidinylmethylindole?
The CAS number of Pyrrolidinylmethylindole is 46421-52-7.
What is the molecular formula of Pyrrolidinylmethylindole?
The molecular formula of Pyrrolidinylmethylindole is C13H16N2.
What is the molecular weight of Pyrrolidinylmethylindole?
The molecular weight of Pyrrolidinylmethylindole is 200.13 g/mol.
Where can I buy Pyrrolidinylmethylindole?
You can request a quote for Pyrrolidinylmethylindole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolidinylmethylindole?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolidinylmethylindole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.