![[(2-methyl-2-nitrocyclopentylidene)amino] N-methylcarbamate structure](/static/products/2041/20417-84-9.webp)
[(2-methyl-2-nitrocyclopentylidene)amino] N-methylcarbamate
TL;DR: [(2-methyl-2-nitrocyclopentylidene)amino] N-methylcarbamate (CAS 20417-84-9) is a chemical compound with molecular formula C8H13N3O4 and molecular weight 215.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2-methyl-2-nitrocyclopentylidene)amino] N-methylcarbamate
Also Known As: 2-Methyl-2-nitrocyclopentanoneO- oxime
| Molecular Formula | C8H13N3O4 |
|---|---|
| Molecular Weight | 215.09 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 96.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 215.0906 |
| Heavy Atoms | 15 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 20417-84-9 |
|---|---|
| SMILES | CC1(CCCC1=NOC(=O)NC)[N+](=O)[O-] |
| InChIKey | AIFXNTVHNKCKJL-UHFFFAOYSA-N |
Product Overview
[(2-methyl-2-nitrocyclopentylidene)amino] N-methylcarbamate (CAS 20417-84-9), with molecular formula C8H13N3O4 and molecular weight 215.09 g/mol. IUPAC: [(2-methyl-2-nitrocyclopentylidene)amino] N-methylcarbamate.
Chemical Property Profile of [(2-methyl-2-nitrocyclopentylidene)amino] N-methylcarbamate
Property Insights of [(2-methyl-2-nitrocyclopentylidene)amino] N-methylcarbamate
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(2-methyl-2-nitrocyclopentylidene)amino] N-methylcarbamate. The TPSA of 96.5 Ų falls within the moderate polarity range, balancing permeability and solubility for [(2-methyl-2-nitrocyclopentylidene)amino] N-methylcarbamate. Following Lipinski's Rule of Five, [(2-methyl-2-nitrocyclopentylidene)amino] N-methylcarbamate 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 [(2-methyl-2-nitrocyclopentylidene)amino] N-methylcarbamate?
The CAS number of [(2-methyl-2-nitrocyclopentylidene)amino] N-methylcarbamate is 20417-84-9.
What is the molecular formula of [(2-methyl-2-nitrocyclopentylidene)amino] N-methylcarbamate?
The molecular formula of [(2-methyl-2-nitrocyclopentylidene)amino] N-methylcarbamate is C8H13N3O4.
What is the molecular weight of [(2-methyl-2-nitrocyclopentylidene)amino] N-methylcarbamate?
The molecular weight of [(2-methyl-2-nitrocyclopentylidene)amino] N-methylcarbamate is 215.09 g/mol.
Where can I buy [(2-methyl-2-nitrocyclopentylidene)amino] N-methylcarbamate?
You can request a quote for [(2-methyl-2-nitrocyclopentylidene)amino] N-methylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(2-methyl-2-nitrocyclopentylidene)amino] N-methylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for [(2-methyl-2-nitrocyclopentylidene)amino] N-methylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.