| CAS Number | 1251303-09-9 |
| Catalog Number | AG01ACW8(AGN-PC-0WO438) |
| Chemical Name | 1,3-dimethyl-5-(piperazin-1-yl)-1H-pyrazol-4-amine |
| IUPAC Name | 1,3-dimethyl-5-piperazin-1-ylpyrazol-4-amine |
| InChI | InChI=1S/C9H17N5/c1-7-8(10)9(13(2)12-7)14-5-3-11-4-6-14/h11H,3-6,10H2,1-2H3 |
| InChI Key | SJWZYGOUZPNTKZ-UHFFFAOYSA-N |
| MDL Number | MFCD16687601 |
| Molecular Formula | C9H17N5 |
| Molecular Weight | 195.2648 |
| SMILES | CC1C(N)=C(N2CCNCC2)N(C)N=1 |
| Synonyms | 1,3-dimethyl-5-(piperazin-1-yl)-1H-pyrazol-4-amine,
1251303-09-9,
ZINC50607426,
AKOS011418874,
NE23630,
|
| Complexity | 192 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.148g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.27g/mol |
| Monoisotopic Mass | 195.148g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 59.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.2 |
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