| CAS Number | 1216016-99-7 |
| Catalog Number | AG01AAYR |
| Chemical Name | N-methyl-1-[6-methyl-2-(propan-2-yl)pyrimidin-4-yl]piperidin-4-amine |
| IUPAC Name | N-methyl-1-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperidin-4-amine |
| InChI | InChI=1S/C14H24N4/c1-10(2)14-16-11(3)9-13(17-14)18-7-5-12(15-4)6-8-18/h9-10,12,15H,5-8H2,1-4H3 |
| InChI Key | VZWMRSZIRKKZOF-UHFFFAOYSA-N |
| MDL Number | MFCD12520337 |
| Molecular Formula | C14H24N4 |
| Molecular Weight | 248.3672 |
| SMILES | CNC1CCN(C2=NC(C(C)C)=NC(C)=C2)CC1 |
| Synonyms | N-methyl-1-[6-methyl-2-(propan-2-yl)pyrimidin-4-yl]piperidin-4-amine,
1216016-99-7,
SCHEMBL784807,
AC1Q4113,
ZINC37537187,
AKOS005916296,
MCULE-1052157847,
NE48424,
EN300-69952,
Z1263811775,
|
| Complexity | 248 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 248.2g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 248.374g/mol |
| Monoisotopic Mass | 248.2g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 41A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number