N-propyl-2H-1,3-benzodioxole-5-carboxamide
TL;DR: N-propyl-2H-1,3-benzodioxole-5-carboxamide (CAS 66232-24-4) is a chemical compound with molecular formula C11H13NO3 and molecular weight 207.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-propyl-1,3-benzodioxole-5-carboxamide
Also Known As: N-propyl-piperonylamide, N-propyl-1,3-benzodioxole-5-carboxamide, N-propylbenzo[1,3]dioxole-5-carboxamide, N-propyl-2H-1,3-benzodioxole-5-carboxamide
| Molecular Formula | C11H13NO3 |
|---|---|
| Molecular Weight | 207.09 g/mol |
| LogP | 1.5551 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 207.08954 |
| Heavy Atoms | 15 |
| Complexity | 376.09583 |
Chemical Identifiers
| CAS Number | 66232-24-4 |
|---|---|
| SMILES | CCCNC(=O)C1=CC2=C(C=C1)OCO2 |
Product Overview
N-propyl-2H-1,3-benzodioxole-5-carboxamide (CAS 66232-24-4), with molecular formula C11H13NO3 and molecular weight 207.09 g/mol. IUPAC: N-propyl-1,3-benzodioxole-5-carboxamide.
Chemical Property Profile of N-propyl-2H-1,3-benzodioxole-5-carboxamide
Property Insights of N-propyl-2H-1,3-benzodioxole-5-carboxamide
The XLogP value of 1.5551 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-propyl-2H-1,3-benzodioxole-5-carboxamide. With a topological polar surface area (TPSA) of 47.56 Ų, N-propyl-2H-1,3-benzodioxole-5-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-propyl-2H-1,3-benzodioxole-5-carboxamide has 1 hydrogen bond donor(s) and 3 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-propyl-2H-1,3-benzodioxole-5-carboxamide?
The CAS number of N-propyl-2H-1,3-benzodioxole-5-carboxamide is 66232-24-4.
What is the molecular formula of N-propyl-2H-1,3-benzodioxole-5-carboxamide?
The molecular formula of N-propyl-2H-1,3-benzodioxole-5-carboxamide is C11H13NO3.
What is the molecular weight of N-propyl-2H-1,3-benzodioxole-5-carboxamide?
The molecular weight of N-propyl-2H-1,3-benzodioxole-5-carboxamide is 207.09 g/mol.
Where can I buy N-propyl-2H-1,3-benzodioxole-5-carboxamide?
You can request a quote for N-propyl-2H-1,3-benzodioxole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-propyl-2H-1,3-benzodioxole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-propyl-2H-1,3-benzodioxole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.