| CAS Number | 459803-08-8 |
| Catalog Number | AG00D9AY(AGN-PC-0WBUMK) |
| Chemical Name | N-(5-Amino-2-methylphenyl)-2-(piperidin-1-yl)acetamide |
| IUPAC Name | N-(5-amino-2-methylphenyl)-2-piperidin-1-ylacetamide |
| InChI | InChI=1S/C14H21N3O/c1-11-5-6-12(15)9-13(11)16-14(18)10-17-7-3-2-4-8-17/h5-6,9H,2-4,7-8,10,15H2,1H3,(H,16,18) |
| InChI Key | IQWGRCZHOQKEGQ-UHFFFAOYSA-N |
| MDL Number | MFCD03117507 |
| Molecular Formula | C14H21N3O |
| Molecular Weight | 247.3360 |
| SMILES | CC1=C(NC(CN2CCCCC2)=O)C=C(N)C=C1 |
| Synonyms | N-(5-Amino-2-methyl-phenyl)-2-piperidin-1-yl-acetamide,
459803-08-8,
N-(5-amino-2-methylphenyl)-2-(piperidin-1-yl)acetamide,
ASN 04358935,
AC1LHAK6,
AC1Q2FTU,
CTK7G4713,
ZINC4170859,
3964AE,
AKOS000100776,
MCULE-8782490348,
NE12340,
TR-043828,
EN300-57172,
N-(5-amino-2-methylphenyl)-2-piperidin-1-ylacetamide,
C14H21N3O,
CID859680,
|
| Complexity | 276 |
| 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 | 3 |
| Topological Polar Surface Area | 58.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number