N-methoxycarbonyl-3-phenyl-1-propylamine
TL;DR: N-methoxycarbonyl-3-phenyl-1-propylamine (CAS 111944-09-3) is a chemical compound with molecular formula C11H15NO2 and molecular weight 193.11028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl N-(3-phenylpropyl)carbamate
Also Known As: Methyl N-(3-phenylpropyl)carbamate, 3-Phenylpropylcarbamic acid methyl ester, N-methoxycarbonyl-3-phenyl-1-propylamine, J2.597.972I
Technical Specifications
| Molecular Formula | C11H15NO2 |
| Molecular Weight | 193.11028 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 193.11028 Da |
| Heavy Atoms | 14 |
| Complexity | 165.0 |
| SMILES | COC(=O)NCCCC1=CC=CC=C1 |
| InChIKey | MYKDOGIIZXFOEQ-UHFFFAOYSA-N |
Chemical Property Profile of N-methoxycarbonyl-3-phenyl-1-propylamine
Property Insights of N-methoxycarbonyl-3-phenyl-1-propylamine
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-methoxycarbonyl-3-phenyl-1-propylamine. With a topological polar surface area (TPSA) of 38.3 Ų, N-methoxycarbonyl-3-phenyl-1-propylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-methoxycarbonyl-3-phenyl-1-propylamine has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-methoxycarbonyl-3-phenyl-1-propylamine?
The CAS number of N-methoxycarbonyl-3-phenyl-1-propylamine is 111944-09-3.
What is the molecular formula of N-methoxycarbonyl-3-phenyl-1-propylamine?
The molecular formula of N-methoxycarbonyl-3-phenyl-1-propylamine is C11H15NO2.
What is the molecular weight of N-methoxycarbonyl-3-phenyl-1-propylamine?
The molecular weight of N-methoxycarbonyl-3-phenyl-1-propylamine is 193.11028 g/mol.
Where can I buy N-methoxycarbonyl-3-phenyl-1-propylamine?
You can request a quote for N-methoxycarbonyl-3-phenyl-1-propylamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-methoxycarbonyl-3-phenyl-1-propylamine?
Yes, CoreyChem provides custom synthesis services for N-methoxycarbonyl-3-phenyl-1-propylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.