| CAS Number | 1060817-46-0 |
| Catalog Number | AG0084EG(AGN-PC-0WB576) |
| Chemical Name | 1-Isobutyrylpiperidin-3-amine |
| IUPAC Name | 1-(3-aminopiperidin-1-yl)-2-methylpropan-1-one |
| InChI | InChI=1S/C9H18N2O/c1-7(2)9(12)11-5-3-4-8(10)6-11/h7-8H,3-6,10H2,1-2H3 |
| InChI Key | TVKJZIJEHHMBTL-UHFFFAOYSA-N |
| MDL Number | MFCD11053965 |
| Molecular Formula | C9H18N2O |
| Molecular Weight | 170.2520 |
| SMILES | N1(CCCC(N)C1)C(C(C)C)=O |
| Synonyms | 1060817-46-0,
1-ISOBUTYRYL-3-PIPERIDINAMINE,
1-isobutyrylpiperidin-3-amine,
1-(3-aminopiperidin-1-yl)-2-methylpropan-1-one,
1-[(3R)-3-Aminopiperidin-1-yl]-2-methylpropan-1-one,
1704966-08-4,
SCHEMBL12413686,
CTK4A4376,
DTXSID80649239,
ALBB-005178,
8294AC,
MFCD11053965,
AKOS005171383,
MCULE-4404752235,
TR-058704,
Y-6562,
C9H18N2O,
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| Complexity | 168 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 170.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 170.256g/mol |
| Monoisotopic Mass | 170.142g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 46.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number