Tert-butyl (1-oxo-1-(p-tolylamino)propan-2-yl)carbamate
TL;DR: Tert-butyl (1-oxo-1-(p-tolylamino)propan-2-yl)carbamate (CAS 1099643-39-6) is a chemical compound with molecular formula C15H22N2O3 and molecular weight 278.16306 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl N-[1-(4-methylanilino)-1-oxopropan-2-yl]carbamate
Also Known As: tert-butyl (1-oxo-1-(p-tolylamino)propan-2-yl)carbamate, Tert-butyl N-[1-[(4-methylphenyl)carbamoyl]ethyl]carbamate, tert-butyl N-[1-(4-methylanilino)-1-oxopropan-2-yl]carbamate
Technical Specifications
| Molecular Formula | C15H22N2O3 |
| Molecular Weight | 278.16306 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 278.16306 Da |
| Heavy Atoms | 20 |
| Complexity | 342.0 |
| SMILES | CC1=CC=C(C=C1)NC(=O)C(C)NC(=O)OC(C)(C)C |
| InChIKey | KBIJTBDQWRCSCQ-UHFFFAOYSA-N |
Chemical Property Profile of Tert-butyl (1-oxo-1-(p-tolylamino)propan-2-yl)carbamate
Property Insights of Tert-butyl (1-oxo-1-(p-tolylamino)propan-2-yl)carbamate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tert-butyl (1-oxo-1-(p-tolylamino)propan-2-yl)carbamate. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Tert-butyl (1-oxo-1-(p-tolylamino)propan-2-yl)carbamate. Following Lipinski's Rule of Five, Tert-butyl (1-oxo-1-(p-tolylamino)propan-2-yl)carbamate 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
What is the CAS number of Tert-butyl (1-oxo-1-(p-tolylamino)propan-2-yl)carbamate?
The CAS number of Tert-butyl (1-oxo-1-(p-tolylamino)propan-2-yl)carbamate is 1099643-39-6.
What is the molecular formula of Tert-butyl (1-oxo-1-(p-tolylamino)propan-2-yl)carbamate?
The molecular formula of Tert-butyl (1-oxo-1-(p-tolylamino)propan-2-yl)carbamate is C15H22N2O3.
What is the molecular weight of Tert-butyl (1-oxo-1-(p-tolylamino)propan-2-yl)carbamate?
The molecular weight of Tert-butyl (1-oxo-1-(p-tolylamino)propan-2-yl)carbamate is 278.16306 g/mol.
Where can I buy Tert-butyl (1-oxo-1-(p-tolylamino)propan-2-yl)carbamate?
You can request a quote for Tert-butyl (1-oxo-1-(p-tolylamino)propan-2-yl)carbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Tert-butyl (1-oxo-1-(p-tolylamino)propan-2-yl)carbamate?
Yes, CoreyChem provides custom synthesis services for Tert-butyl (1-oxo-1-(p-tolylamino)propan-2-yl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.