| CAS Number | 1218021-92-1 |
| Catalog Number | AG01A90A |
| Chemical Name | 2-amino-N-[3-(pyrrolidin-1-yl)phenyl]pentanamide |
| IUPAC Name | 2-amino-N-(3-pyrrolidin-1-ylphenyl)pentanamide |
| InChI | InChI=1S/C15H23N3O/c1-2-6-14(16)15(19)17-12-7-5-8-13(11-12)18-9-3-4-10-18/h5,7-8,11,14H,2-4,6,9-10,16H2,1H3,(H,17,19) |
| InChI Key | XTRCVIYFRMUELA-UHFFFAOYSA-N |
| MDL Number | MFCD12834234 |
| Molecular Formula | C15H23N3O |
| Molecular Weight | 261.3626 |
| SMILES | CCCC(C(NC1=CC(N2CCCC2)=CC=C1)=O)N |
| Synonyms | 2-amino-N-[3-(pyrrolidin-1-yl)phenyl]pentanamide,
1218021-92-1,
AC1Q2ULV,
AKOS010151638,
MCULE-3071102167,
NE24282,
EN300-63882,
Z1101435012,
|
| Complexity | 289 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 261.184g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 261.369g/mol |
| Monoisotopic Mass | 261.184g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 58.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number