| CAS Number | 51-07-0 |
| Catalog Number | AG01AHP1 |
| Chemical Name | 4-amino-N-[2-(pyrrolidin-1-yl)ethyl]benzamide |
| IUPAC Name | 4-amino-N-(2-pyrrolidin-1-ylethyl)benzamide |
| InChI | InChI=1S/C13H19N3O/c14-12-5-3-11(4-6-12)13(17)15-7-10-16-8-1-2-9-16/h3-6H,1-2,7-10,14H2,(H,15,17) |
| InChI Key | UZKAUYQJRVDEAV-UHFFFAOYSA-N |
| MDL Number | MFCD06808528 |
| Molecular Formula | C13H19N3O |
| Molecular Weight | 233.3095 |
| SMILES | NC1=CC=C(C(NCCN2CCCC2)=O)C=C1 |
| Synonyms | 4-amino-N-[2-(pyrrolidin-1-yl)ethyl]benzamide,
51-07-0,
SCHEMBL3408343,
ZINC35663375,
AKOS008131957,
MCULE-3060999831,
NE39385,
EN300-75371,
Z1180083012,
|
| Complexity | 243 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 233.153g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 233.315g/mol |
| Monoisotopic Mass | 233.153g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 58.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number