| CAS Number | 1016530-73-6 |
| Catalog Number | AG01AH24 |
| Chemical Name | N-[4-(3-oxobutanamido)phenyl]cyclopropanecarboxamide |
| IUPAC Name | N-[4-(3-oxobutanoylamino)phenyl]cyclopropanecarboxamide |
| InChI | InChI=1S/C14H16N2O3/c1-9(17)8-13(18)15-11-4-6-12(7-5-11)16-14(19)10-2-3-10/h4-7,10H,2-3,8H2,1H3,(H,15,18)(H,16,19) |
| InChI Key | NYVCZFMFLUTDHK-UHFFFAOYSA-N |
| MDL Number | MFCD09817230 |
| Molecular Formula | C14H16N2O3 |
| Molecular Weight | 260.2884 |
| SMILES | CC(CC(NC1=CC=C(NC(C2CC2)=O)C=C1)=O)=O |
| Synonyms | N-[4-(3-OXOBUTANAMIDO)PHENYL]CYCLOPROPANECARBOXAMIDE,
1016530-73-6,
CTK7G5830,
ZINC19408848,
AKOS000166386,
MCULE-4400981505,
NE47360,
EN300-73465,
Z1162910734,
|
| Complexity | 369 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 260.116092g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 260.29g/mol |
| Monoisotopic Mass | 260.116092g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 75.3Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
Lot Number