1-Benzyl-3-(tert-butoxycarbonylamino)pyrrolidine
TL;DR: 1-Benzyl-3-(tert-butoxycarbonylamino)pyrrolidine (CAS 131852-53-4) is a chemical compound with molecular formula C16H24N2O2 and molecular weight 276.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-(1-benzylpyrrolidin-3-yl)carbamate
Also Known As: tert-Butyl (1-benzylpyrrolidin-3-yl)carbamate, 1-Benzyl-3-(tert-butoxycarbonylamino)pyrrolidine, Tert-butyl N-(1-benzylpyrrolidin-3-yl)carbamate, Ethoxylated polyarylphenol, 1-Benzyl-3-(Boc-amino)pyrrolidine
| Molecular Formula | C16H24N2O2 |
|---|---|
| Molecular Weight | 276.18 g/mol |
| LogP | 2.7856 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 276.18378 |
| Heavy Atoms | 20 |
| Complexity | 439.54013 |
Chemical Identifiers
| CAS Number | 131852-53-4 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NC1CCN(C1)CC2=CC=CC=C2 |
Product Overview
1-Benzyl-3-(tert-butoxycarbonylamino)pyrrolidine (CAS 131852-53-4), with molecular formula C16H24N2O2 and molecular weight 276.18 g/mol. IUPAC: tert-butyl N-(1-benzylpyrrolidin-3-yl)carbamate.
Chemical Property Profile of 1-Benzyl-3-(tert-butoxycarbonylamino)pyrrolidine
Property Insights of 1-Benzyl-3-(tert-butoxycarbonylamino)pyrrolidine
The XLogP value of 2.7856 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzyl-3-(tert-butoxycarbonylamino)pyrrolidine. With a topological polar surface area (TPSA) of 41.57 Ų, 1-Benzyl-3-(tert-butoxycarbonylamino)pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-3-(tert-butoxycarbonylamino)pyrrolidine has 1 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 1-Benzyl-3-(tert-butoxycarbonylamino)pyrrolidine?
The CAS number of 1-Benzyl-3-(tert-butoxycarbonylamino)pyrrolidine is 131852-53-4.
What is the molecular formula of 1-Benzyl-3-(tert-butoxycarbonylamino)pyrrolidine?
The molecular formula of 1-Benzyl-3-(tert-butoxycarbonylamino)pyrrolidine is C16H24N2O2.
What is the molecular weight of 1-Benzyl-3-(tert-butoxycarbonylamino)pyrrolidine?
The molecular weight of 1-Benzyl-3-(tert-butoxycarbonylamino)pyrrolidine is 276.18 g/mol.
Where can I buy 1-Benzyl-3-(tert-butoxycarbonylamino)pyrrolidine?
You can request a quote for 1-Benzyl-3-(tert-butoxycarbonylamino)pyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-3-(tert-butoxycarbonylamino)pyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-3-(tert-butoxycarbonylamino)pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.