2-Ethyl-1,3-dimethylhexahydropyrimidine
TL;DR: 2-Ethyl-1,3-dimethylhexahydropyrimidine (CAS 22385-51-9) is a chemical compound with molecular formula C8H18N2 and molecular weight 142.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-1,3-dimethyl-1,3-diazinane
Also Known As: 2-ethyl-1,3-dimethyl-1,3-diazinane, 2-ethyl-1,3-dimethylhexahydropyrimidine
| Molecular Formula | C8H18N2 |
|---|---|
| Molecular Weight | 142.15 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 6.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 142.147 |
| Heavy Atoms | 10 |
| Complexity | 93.0 |
Chemical Identifiers
| CAS Number | 22385-51-9 |
|---|---|
| SMILES | CCC1N(CCCN1C)C |
| InChIKey | SFPKPXDJZVKVRD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Ethyl-1,3-dimethylhexahydropyrimidine (CAS 22385-51-9), with molecular formula C8H18N2 and molecular weight 142.15 g/mol. IUPAC: 2-ethyl-1,3-dimethyl-1,3-diazinane.
Chemical Property Profile of 2-Ethyl-1,3-dimethylhexahydropyrimidine
Property Insights of 2-Ethyl-1,3-dimethylhexahydropyrimidine
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Ethyl-1,3-dimethylhexahydropyrimidine. With a topological polar surface area (TPSA) of 6.5 Ų, 2-Ethyl-1,3-dimethylhexahydropyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethyl-1,3-dimethylhexahydropyrimidine has 0 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-Ethyl-1,3-dimethylhexahydropyrimidine?
The CAS number of 2-Ethyl-1,3-dimethylhexahydropyrimidine is 22385-51-9.
What is the molecular formula of 2-Ethyl-1,3-dimethylhexahydropyrimidine?
The molecular formula of 2-Ethyl-1,3-dimethylhexahydropyrimidine is C8H18N2.
What is the molecular weight of 2-Ethyl-1,3-dimethylhexahydropyrimidine?
The molecular weight of 2-Ethyl-1,3-dimethylhexahydropyrimidine is 142.15 g/mol.
Where can I buy 2-Ethyl-1,3-dimethylhexahydropyrimidine?
You can request a quote for 2-Ethyl-1,3-dimethylhexahydropyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethyl-1,3-dimethylhexahydropyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethyl-1,3-dimethylhexahydropyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.