| CAS Number | 926263-60-7 |
| Catalog Number | AG019W3B |
| Chemical Name | N-[3-(aminomethyl)phenyl]cyclopentanecarboxamide |
| IUPAC Name | N-[3-(aminomethyl)phenyl]cyclopentanecarboxamide |
| InChI | InChI=1S/C13H18N2O/c14-9-10-4-3-7-12(8-10)15-13(16)11-5-1-2-6-11/h3-4,7-8,11H,1-2,5-6,9,14H2,(H,15,16) |
| InChI Key | IJANKGMHOUKLIW-UHFFFAOYSA-N |
| MDL Number | MFCD09046755 |
| Molecular Formula | C13H18N2O |
| Molecular Weight | 218.2948 |
| SMILES | NCC1=CC(NC(C2CCCC2)=O)=CC=C1 |
| Synonyms | N-[3-(aminomethyl)phenyl]cyclopentanecarboxamide,
926263-60-7,
AC1Q53VW,
CTK7E5540,
ZINC21967363,
AKOS000130844,
MCULE-3900303890,
EN300-50344,
Z1267773673,
|
| Complexity | 236 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 218.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 218.3g/mol |
| Monoisotopic Mass | 218.142g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number