N-(1,3-benzodioxol-5-yl)morpholine-4-carboxamide
TL;DR: N-(1,3-benzodioxol-5-yl)morpholine-4-carboxamide (CAS 698984-83-7) is a chemical compound with molecular formula C12H14N2O4 and molecular weight 250.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)morpholine-4-carboxamide
Also Known As: N-(1,3-benzodioxol-5-yl)morpholine-4-carboxamide, N-1,3-benzodioxol-5-yl-4-morpholinecarboxamide, 4-Morpholinecarboxamide,N-1,3-benzodioxol-5-yl-(9CI), N-(benzo[d][1,3]dioxol-5-yl)morpholine-4-carboxamide, 4-Morpholinecarboxamide, N-1,3-benzodioxol-5-yl- (9CI)
| Molecular Formula | C12H14N2O4 |
|---|---|
| Molecular Weight | 250.10 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 60.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 250.09535 |
| Heavy Atoms | 18 |
| Complexity | 306.0 |
Chemical Identifiers
| CAS Number | 698984-83-7 |
|---|---|
| SMILES | C1COCCN1C(=O)NC2=CC3=C(C=C2)OCO3 |
| InChIKey | ZQIKURSYQJVIRT-UHFFFAOYSA-N |
Product Overview
N-(1,3-benzodioxol-5-yl)morpholine-4-carboxamide (CAS 698984-83-7), with molecular formula C12H14N2O4 and molecular weight 250.10 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)morpholine-4-carboxamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-yl)morpholine-4-carboxamide
Property Insights of N-(1,3-benzodioxol-5-yl)morpholine-4-carboxamide
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-benzodioxol-5-yl)morpholine-4-carboxamide. The TPSA of 60.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-yl)morpholine-4-carboxamide. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-yl)morpholine-4-carboxamide has 1 hydrogen bond donor(s) and 4 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-(1,3-benzodioxol-5-yl)morpholine-4-carboxamide?
The CAS number of N-(1,3-benzodioxol-5-yl)morpholine-4-carboxamide is 698984-83-7.
What is the molecular formula of N-(1,3-benzodioxol-5-yl)morpholine-4-carboxamide?
The molecular formula of N-(1,3-benzodioxol-5-yl)morpholine-4-carboxamide is C12H14N2O4.
What is the molecular weight of N-(1,3-benzodioxol-5-yl)morpholine-4-carboxamide?
The molecular weight of N-(1,3-benzodioxol-5-yl)morpholine-4-carboxamide is 250.10 g/mol.
Where can I buy N-(1,3-benzodioxol-5-yl)morpholine-4-carboxamide?
You can request a quote for N-(1,3-benzodioxol-5-yl)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-(1,3-benzodioxol-5-yl)morpholine-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-yl)morpholine-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.