| CAS Number | 1158646-42-4 |
| Catalog Number | AG01ABBH |
| Chemical Name | 4-ethoxy-6-methyl-2-(piperazin-1-yl)pyrimidine |
| IUPAC Name | 4-ethoxy-6-methyl-2-piperazin-1-ylpyrimidine |
| InChI | InChI=1S/C11H18N4O/c1-3-16-10-8-9(2)13-11(14-10)15-6-4-12-5-7-15/h8,12H,3-7H2,1-2H3 |
| InChI Key | FRTZIXXEGGMDDO-UHFFFAOYSA-N |
| MDL Number | MFCD15201891 |
| Molecular Formula | C11H18N4O |
| Molecular Weight | 222.2868 |
| SMILES | CCOC1=NC(N2CCNCC2)=NC(C)=C1 |
| Synonyms | 4-ethoxy-6-methyl-2-(piperazin-1-yl)pyrimidine,
1158646-42-4,
ZINC58825886,
MCULE-3566289432,
NE20553,
4-ethoxy-6-methyl-2-piperazin-1-ylpyrimidine,
EN300-71092,
Z1266823214,
|
| Complexity | 208 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 222.148g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 222.292g/mol |
| Monoisotopic Mass | 222.148g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 50.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number