| CAS Number | 926199-67-9 |
| Catalog Number | AG019U9R(AGN-PC-0WBX8L) |
| Chemical Name | N-(5-amino-2-fluorophenyl)cyclohexanecarboxamide |
| IUPAC Name | N-(5-amino-2-fluorophenyl)cyclohexanecarboxamide |
| InChI | InChI=1S/C13H17FN2O/c14-11-7-6-10(15)8-12(11)16-13(17)9-4-2-1-3-5-9/h6-9H,1-5,15H2,(H,16,17) |
| InChI Key | AEMBEDJANFYSAP-UHFFFAOYSA-N |
| MDL Number | MFCD09044549 |
| Molecular Formula | C13H17FN2O |
| Molecular Weight | 236.2853 |
| SMILES | NC1=CC(NC(C2CCCCC2)=O)=C(F)C=C1 |
| Synonyms | N-(5-amino-2-fluorophenyl)cyclohexanecarboxamide,
926199-67-9,
AC1Q51PW,
CTK7F8411,
ZINC19736578,
AKOS000128638,
MCULE-6117656786,
NE40612,
TR-049266,
EN300-41033,
|
| Complexity | 266 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 236.132g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 236.29g/mol |
| Monoisotopic Mass | 236.132g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number