| CAS Number | 1129400-99-2 |
| Catalog Number | AG019Z6R(AGN-PC-0WO4QD) |
| Chemical Name | 3-methyl-1-(pyrimidin-2-yl)-1H-pyrazol-5-amine |
| IUPAC Name | 5-methyl-2-pyrimidin-2-ylpyrazol-3-amine |
| InChI | InChI=1S/C8H9N5/c1-6-5-7(9)13(12-6)8-10-3-2-4-11-8/h2-5H,9H2,1H3 |
| InChI Key | NBTODGHAMDDPDX-UHFFFAOYSA-N |
| MDL Number | MFCD12190039 |
| Molecular Formula | C8H9N5 |
| Molecular Weight | 175.1906 |
| SMILES | CC1=NN(C2=NC=CC=N2)C(N)=C1 |
| Synonyms | 3-methyl-1-(pyrimidin-2-yl)-1H-pyrazol-5-amine,
1129400-99-2,
SCHEMBL824603,
BBL032178,
STK943603,
ZINC35206562,
AKOS005672624,
MCULE-4155346167,
NE18172,
Z277560070,
5-methyl-2-pyrimidin-2-ylpyrazol-3-amine,
|
| Complexity | 168 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 175.086g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 175.195g/mol |
| Monoisotopic Mass | 175.086g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 69.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number