1,1-Dimethylethyl N-(3-((3-aminopropyl)amino)propyl)carbamate
TL;DR: 1,1-Dimethylethyl N-(3-((3-aminopropyl)amino)propyl)carbamate (CAS 167568-21-0) is a chemical compound with molecular formula C11H25N3O2 and molecular weight 231.19467 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl N-[3-(3-aminopropylamino)propyl]carbamate
Also Known As: BOC-3,3'-IMINODIPROPYLAMINE, AURORA KA-4391, N-Boc-3,3'-diaminodipropylamine, Tert-butyl N-[3-(3-aminopropylamino)propyl]carbamate, tert-butyl N-{3-[(3-aminopropyl)amino]propyl}carbamate
Technical Specifications
| Molecular Formula | C11H25N3O2 |
| Molecular Weight | 231.19467 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 76.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 231.19467 Da |
| Heavy Atoms | 16 |
| Complexity | 190.0 |
| SMILES | CC(C)(C)OC(=O)NCCCNCCCN |
| InChIKey | DZFPOUXCPWBUDA-UHFFFAOYSA-N |
Chemical Property Profile of 1,1-Dimethylethyl N-(3-((3-aminopropyl)amino)propyl)carbamate
Property Insights of 1,1-Dimethylethyl N-(3-((3-aminopropyl)amino)propyl)carbamate
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1-Dimethylethyl N-(3-((3-aminopropyl)amino)propyl)carbamate. The TPSA of 76.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1-Dimethylethyl N-(3-((3-aminopropyl)amino)propyl)carbamate. Following Lipinski's Rule of Five, 1,1-Dimethylethyl N-(3-((3-aminopropyl)amino)propyl)carbamate has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,1-Dimethylethyl N-(3-((3-aminopropyl)amino)propyl)carbamate?
The CAS number of 1,1-Dimethylethyl N-(3-((3-aminopropyl)amino)propyl)carbamate is 167568-21-0.
What is the molecular formula of 1,1-Dimethylethyl N-(3-((3-aminopropyl)amino)propyl)carbamate?
The molecular formula of 1,1-Dimethylethyl N-(3-((3-aminopropyl)amino)propyl)carbamate is C11H25N3O2.
What is the molecular weight of 1,1-Dimethylethyl N-(3-((3-aminopropyl)amino)propyl)carbamate?
The molecular weight of 1,1-Dimethylethyl N-(3-((3-aminopropyl)amino)propyl)carbamate is 231.19467 g/mol.
Where can I buy 1,1-Dimethylethyl N-(3-((3-aminopropyl)amino)propyl)carbamate?
You can request a quote for 1,1-Dimethylethyl N-(3-((3-aminopropyl)amino)propyl)carbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,1-Dimethylethyl N-(3-((3-aminopropyl)amino)propyl)carbamate?
Yes, CoreyChem provides custom synthesis services for 1,1-Dimethylethyl N-(3-((3-aminopropyl)amino)propyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.