| CAS Number | 851814-16-9 |
| Catalog Number | AG00IDKI(AGN-PC-0WQYER) |
| Chemical Name | N-(2-ethylphenyl)-2-(piperazin-1-yl)acetamide |
| IUPAC Name | N-(2-ethylphenyl)-2-piperazin-1-ylacetamide |
| InChI | InChI=1S/C14H21N3O/c1-2-12-5-3-4-6-13(12)16-14(18)11-17-9-7-15-8-10-17/h3-6,15H,2,7-11H2,1H3,(H,16,18) |
| InChI Key | UPAZJBWZWGMLTL-UHFFFAOYSA-N |
| MDL Number | MFCD06386703 |
| Molecular Formula | C14H21N3O |
| Molecular Weight | 247.3360 |
| SMILES | CCC1=C(NC(CN2CCNCC2)=O)C=CC=C1 |
| Synonyms | N-(2-ethylphenyl)-2-piperazin-1-ylacetamide,
851814-16-9,
N-(2-ethylphenyl)-2-(piperazin-1-yl)acetamide,
AC1Q2SXX,
AC1M8P9U,
CTK6D2256,
HMS1764C15,
MFCD06386703,
ZINC19976722,
AKOS002683157,
MCULE-8906746864,
NE13265,
EN300-12221,
Z85931736,
CID2517694,
N-(2-ethylphenyl)-2-piperazin-1-yl-acetamide,
|
| Complexity | 264 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 247.168g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 247.342g/mol |
| Monoisotopic Mass | 247.168g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 44.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number