N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]cyclopentanamine
TL;DR: N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]cyclopentanamine (CAS 355397-02-3) is a chemical compound with molecular formula C13H16N2O4 and molecular weight 264.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]cyclopentanamine
Also Known As: N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]cyclopentanamine, N-[(6-nitrobenzo[1,3]dioxol-5-yl)methyl]cyclopentanamine
| Molecular Formula | C13H16N2O4 |
|---|---|
| Molecular Weight | 264.11 g/mol |
| LogP | 2.3557 |
| Topological Polar Surface Area | 73.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 264.111 |
| Heavy Atoms | 19 |
| Complexity | 497.66174 |
Chemical Identifiers
| CAS Number | 355397-02-3 |
|---|---|
| SMILES | C1CCC(C1)NCC2=CC3=C(C=C2[N+](=O)[O-])OCO3 |
Product Overview
N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]cyclopentanamine (CAS 355397-02-3), with molecular formula C13H16N2O4 and molecular weight 264.11 g/mol. IUPAC: N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]cyclopentanamine.
Chemical Property Profile of N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]cyclopentanamine
Property Insights of N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]cyclopentanamine
The XLogP value of 2.3557 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]cyclopentanamine. The TPSA of 73.63 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]cyclopentanamine. Following Lipinski's Rule of Five, N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]cyclopentanamine has 1 hydrogen bond donor(s) and 5 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-[(6-nitro-1,3-benzodioxol-5-yl)methyl]cyclopentanamine?
The CAS number of N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]cyclopentanamine is 355397-02-3.
What is the molecular formula of N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]cyclopentanamine?
The molecular formula of N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]cyclopentanamine is C13H16N2O4.
What is the molecular weight of N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]cyclopentanamine?
The molecular weight of N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]cyclopentanamine is 264.11 g/mol.
Where can I buy N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]cyclopentanamine?
You can request a quote for N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]cyclopentanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]cyclopentanamine?
Yes, KEHONG BIO provides custom synthesis services for N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]cyclopentanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.