| CAS Number | 1017163-98-2 |
| Catalog Number | AG01C09Y |
| Chemical Name | 2-(piperidin-4-ylmethyl)thiazole |
| IUPAC Name | 2-(piperidin-4-ylmethyl)-1,3-thiazole |
| InChI | InChI=1S/C9H14N2S/c1-3-10-4-2-8(1)7-9-11-5-6-12-9/h5-6,8,10H,1-4,7H2 |
| InChI Key | WJVMBLXNPUNVRW-UHFFFAOYSA-N |
| MDL Number | MFCD09891834 |
| Molecular Formula | C9H14N2S |
| Molecular Weight | 182.2859 |
| SMILES | S1C(=NC=C1)CC1CCNCC1 |
| Synonyms | 1017163-98-2,
2-(piperidin-4-ylmethyl)thiazole,
ZINC11884019,
AKOS006314870,
CCG-210081,
4-(1,3-thiazol-2-ylmethyl)piperidine,
4-[(1,3-Thiazol-2-yl)methyl]piperidine,
|
| Complexity | 135 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 182.088g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 182.285g/mol |
| Monoisotopic Mass | 182.088g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 53.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number