| CAS Number | 1459704-38-1 |
| Catalog Number | AG01BFYL |
| Chemical Name | N-[(2-Aminophenyl)methyl]cyclohexanecarboxamide |
| IUPAC Name | N-[(2-aminophenyl)methyl]cyclohexanecarboxamide |
| InChI | InChI=1S/C14H20N2O/c15-13-9-5-4-8-12(13)10-16-14(17)11-6-2-1-3-7-11/h4-5,8-9,11H,1-3,6-7,10,15H2,(H,16,17) |
| InChI Key | IRWRXPSYKQPBFA-UHFFFAOYSA-N |
| MDL Number | MFCD15501172 |
| Molecular Formula | C14H20N2O |
| Molecular Weight | 232.3214 |
| SMILES | NC1=C(CNC(C2CCCCC2)=O)C=CC=C1 |
| Synonyms | N-[(2-aminophenyl)methyl]cyclohexanecarboxamide,
1459704-38-1,
ZINC50015114,
AKOS011271384,
NE60376,
|
| Complexity | 249 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 232.158g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 232.327g/mol |
| Monoisotopic Mass | 232.158g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number