| CAS Number | 1187385-66-5 |
| Catalog Number | AG003BF1(AGN-PC-0WD2EG) |
| Chemical Name | (1-2-Piperidinoethyl)pyrazole |
| IUPAC Name | 1-(2-pyrazol-1-ylethyl)piperidine |
| InChI | InChI=1S/C10H17N3/c1-2-6-12(7-3-1)9-10-13-8-4-5-11-13/h4-5,8H,1-3,6-7,9-10H2 |
| InChI Key | XDCODYPNQAXQEL-UHFFFAOYSA-N |
| MDL Number | MFCD03727253 |
| Molecular Formula | C10H17N3 |
| Molecular Weight | 179.2621 |
| SMILES | C1CCN(CC1)CCn1cccn1 |
| Synonyms | 1-(2-(1H-Pyrazol-1-yl)ethyl)piperidine,
1187385-66-5,
(1-2-PIPERIDINOETHYL)PYRAZOLE,
1-[2-(1H-Pyrazol-1-yl)ethyl]piperidine,
SCHEMBL12844,
DTXSID80675199,
MFCD03727253,
ZINC38537760,
AKOS010475080,
MCULE-8157726693,
AJ-96224,
K-1328,
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| Complexity | 143 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 179.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 179.267g/mol |
| Monoisotopic Mass | 179.142g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 21.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
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Certificate of Analysis
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