| CAS Number | 1251330-45-6 |
| Catalog Number | AG01AIIR(AGN-PC-0WOC66) |
| Chemical Name | 1-(1-methyl-1H-pyrazol-4-yl)piperidin-3-amine |
| IUPAC Name | 1-(1-methylpyrazol-4-yl)piperidin-3-amine |
| InChI | InChI=1S/C9H16N4/c1-12-7-9(5-11-12)13-4-2-3-8(10)6-13/h5,7-8H,2-4,6,10H2,1H3 |
| InChI Key | ZZHPYRMKQBXJDI-UHFFFAOYSA-N |
| MDL Number | MFCD16074678 |
| Molecular Formula | C9H16N4 |
| Molecular Weight | 180.2501 |
| SMILES | CN1N=CC(N2CC(N)CCC2)=C1 |
| Synonyms | 1-(1-methyl-1H-pyrazol-4-yl)piperidin-3-amine,
1251330-45-6,
SCHEMBL16042491,
AKOS010946770,
MCULE-7859194114,
NE22943,
FT-0745465,
EN300-77963,
Z1259161636,
1-(1-methyl-1H-pyrazol-4-yl)-3-Piperidinamine,
|
| Complexity | 173 |
| 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 | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number