N-(3-iodobenzyl)morpholine-4-carboxamide
TL;DR: N-(3-iodobenzyl)morpholine-4-carboxamide (CAS 539805-70-4) is a chemical compound with molecular formula C12H15IN2O2 and molecular weight 346.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-iodophenyl)methyl]morpholine-4-carboxamide
Also Known As: N-(3-iodobenzyl)morpholine-4-carboxamide, N-(3-iodobenzyl)-4-morpholinecarboxamide, VU0488997-1, N-(m-iodophenyl)methyl-4-morpholinecarboxamide, F1243-0106
| Molecular Formula | C12H15IN2O2 |
|---|---|
| Molecular Weight | 346.02 g/mol |
| LogP | 1.833 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 346.01782 |
| Heavy Atoms | 17 |
| Complexity | 391.84695 |
Chemical Identifiers
| CAS Number | 539805-70-4 |
|---|---|
| SMILES | C1COCCN1C(=O)NCC2=CC(=CC=C2)I |
Product Overview
N-(3-iodobenzyl)morpholine-4-carboxamide (CAS 539805-70-4), with molecular formula C12H15IN2O2 and molecular weight 346.02 g/mol. IUPAC: N-[(3-iodophenyl)methyl]morpholine-4-carboxamide.
Chemical Property Profile of N-(3-iodobenzyl)morpholine-4-carboxamide
Property Insights of N-(3-iodobenzyl)morpholine-4-carboxamide
The XLogP value of 1.833 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-iodobenzyl)morpholine-4-carboxamide. With a topological polar surface area (TPSA) of 41.57 Ų, N-(3-iodobenzyl)morpholine-4-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-iodobenzyl)morpholine-4-carboxamide 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-(3-iodobenzyl)morpholine-4-carboxamide?
The CAS number of N-(3-iodobenzyl)morpholine-4-carboxamide is 539805-70-4.
What is the molecular formula of N-(3-iodobenzyl)morpholine-4-carboxamide?
The molecular formula of N-(3-iodobenzyl)morpholine-4-carboxamide is C12H15IN2O2.
What is the molecular weight of N-(3-iodobenzyl)morpholine-4-carboxamide?
The molecular weight of N-(3-iodobenzyl)morpholine-4-carboxamide is 346.02 g/mol.
Where can I buy N-(3-iodobenzyl)morpholine-4-carboxamide?
You can request a quote for N-(3-iodobenzyl)morpholine-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-iodobenzyl)morpholine-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-iodobenzyl)morpholine-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.