| CAS Number | 1246550-66-2 |
| Catalog Number | AG01BFOW(AGN-PC-0WOVDP) |
| Chemical Name | 1-(1-Methyl-4-piperidinyl)-1H-pyrazol-3-amine |
| IUPAC Name | 1-(1-methylpiperidin-4-yl)pyrazol-3-amine |
| InChI | InChI=1S/C9H16N4/c1-12-5-2-8(3-6-12)13-7-4-9(10)11-13/h4,7-8H,2-3,5-6H2,1H3,(H2,10,11) |
| InChI Key | HNNCKVWIQIKZBN-UHFFFAOYSA-N |
| MDL Number | MFCD22393285 |
| Molecular Formula | C9H16N4 |
| Molecular Weight | 180.2501 |
| SMILES | CN1CCC(CC1)N1N=C(C=C1)N |
| Synonyms | 1-(1-methylpiperidin-4-yl)-1H-pyrazol-3-amine,
1246550-66-2,
ZINC98209863,
AKOS024059767,
NE40469,
Z1895741763,
|
| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 180.137g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 180.255g/mol |
| Monoisotopic Mass | 180.137g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 47.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
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