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 193.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
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
| Molecular Formula | C11H15NO2 |
|---|---|
| Molecular Weight | 193.11 g/mol |
| LogP | 1.9752 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 193.11028 |
| Heavy Atoms | 14 |
| Complexity | 271.87582 |
Chemical Identifiers
| CAS Number | 111944-09-3 |
|---|---|
| SMILES | COC(=O)NCCCC1=CC=CC=C1 |
Product Overview
N-methoxycarbonyl-3-phenyl-1-propylamine (CAS 111944-09-3), with molecular formula C11H15NO2 and molecular weight 193.11 g/mol. IUPAC: methyl N-(3-phenylpropyl)carbamate.
Chemical Property Profile of N-methoxycarbonyl-3-phenyl-1-propylamine
Property Insights of N-methoxycarbonyl-3-phenyl-1-propylamine
The XLogP value of 1.9752 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-methoxycarbonyl-3-phenyl-1-propylamine. With a topological polar surface area (TPSA) of 38.33 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
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 193.11 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 KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-methoxycarbonyl-3-phenyl-1-propylamine?
Yes, KEHONG BIO 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.