2-Cyano-1-(1-methylazepan-2-ylidene)guanidine
TL;DR: 2-Cyano-1-(1-methylazepan-2-ylidene)guanidine (CAS 114898-96-3) is a chemical compound with molecular formula C9H15N5 and molecular weight 193.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyano-1-(1-methylazepan-2-ylidene)guanidine
Also Known As: (1-Methylhexahydroazepinylidene-2)dicyanodiamide, Guanidine,N-cyano-N'-(hexahydro-1-methyl-2H-azepin-2-ylidene)-, N-Cyano-N'-(hexahydro-1-methyl-2H-azepin-2-ylidene)guanidine, Guanidine, N-cyano-N'-(hexahydro-1-methyl-2H-azepin-2-ylidene)-
| Molecular Formula | C9H15N5 |
|---|---|
| Molecular Weight | 193.13 g/mol |
| LogP | 0.68648 |
| Topological Polar Surface Area | 77.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 193.13275 |
| Heavy Atoms | 14 |
| Complexity | 286.06766 |
Chemical Identifiers
| CAS Number | 114898-96-3 |
|---|---|
| SMILES | CN1CCCCCC1=NC(=NC#N)N |
Product Overview
2-Cyano-1-(1-methylazepan-2-ylidene)guanidine (CAS 114898-96-3), with molecular formula C9H15N5 and molecular weight 193.13 g/mol. IUPAC: 2-cyano-1-(1-methylazepan-2-ylidene)guanidine.
Chemical Property Profile of 2-Cyano-1-(1-methylazepan-2-ylidene)guanidine
Property Insights of 2-Cyano-1-(1-methylazepan-2-ylidene)guanidine
The XLogP value of 0.68648 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Cyano-1-(1-methylazepan-2-ylidene)guanidine. The TPSA of 77.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Cyano-1-(1-methylazepan-2-ylidene)guanidine. Following Lipinski's Rule of Five, 2-Cyano-1-(1-methylazepan-2-ylidene)guanidine 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 2-Cyano-1-(1-methylazepan-2-ylidene)guanidine?
The CAS number of 2-Cyano-1-(1-methylazepan-2-ylidene)guanidine is 114898-96-3.
What is the molecular formula of 2-Cyano-1-(1-methylazepan-2-ylidene)guanidine?
The molecular formula of 2-Cyano-1-(1-methylazepan-2-ylidene)guanidine is C9H15N5.
What is the molecular weight of 2-Cyano-1-(1-methylazepan-2-ylidene)guanidine?
The molecular weight of 2-Cyano-1-(1-methylazepan-2-ylidene)guanidine is 193.13 g/mol.
Where can I buy 2-Cyano-1-(1-methylazepan-2-ylidene)guanidine?
You can request a quote for 2-Cyano-1-(1-methylazepan-2-ylidene)guanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Cyano-1-(1-methylazepan-2-ylidene)guanidine?
Yes, KEHONG BIO provides custom synthesis services for 2-Cyano-1-(1-methylazepan-2-ylidene)guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.