| CAS Number | 791079-98-6 |
| Catalog Number | AG00GIP7(AGN-PC-0WNL9Z) |
| Chemical Name | 2-(4-Methylpiperidin-1-yl)-2-(thiophen-2-yl)ethanamine |
| IUPAC Name | 2-(4-methylpiperidin-1-yl)-2-thiophen-2-ylethanamine |
| InChI | InChI=1S/C12H20N2S/c1-10-4-6-14(7-5-10)11(9-13)12-3-2-8-15-12/h2-3,8,10-11H,4-7,9,13H2,1H3 |
| InChI Key | HJPGNUUFVKJORI-UHFFFAOYSA-N |
| MDL Number | MFCD06360137 |
| Molecular Formula | C12H20N2S |
| Molecular Weight | 224.3656 |
| SMILES | CC1CCN(C(C2SC=CC=2)CN)CC1 |
| Synonyms | 791079-98-6,
2-(4-Methyl-piperidin-1-yl)-2-thiophen-2-yl-ethylamine,
2-(4-methylpiperidin-1-yl)-2-thien-2-ylethanamine,
2-(4-methylpiperidin-1-yl)-2-(thiophen-2-yl)ethanamine,
2-(4-methylpiperidin-1-yl)-2-(thiophen-2-yl)ethan-1-amine,
AC1Q2R7T,
CTK7E3060,
DTXSID90402276,
AC1N9073,
9807AE,
MFCD06360137,
AKOS000263192,
MCULE-5019787965,
NE13215,
TR-056232,
EN300-10367,
2-(4-methylpiperidin-1-yl)-2-thiophen-2-ylethanamine,
F8881-6666,
C12H20N2S,
CID4352910,
2-(4-methyl-1-piperidyl)-2-thiophen-2-yl-ethanamine,
|
| Complexity | 190 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 224.135g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 224.366g/mol |
| Monoisotopic Mass | 224.135g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 57.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number