AC1NAQ1E
1-(4-benzylpiperidine-1-carbonyl)-4,7,7-trimethyl-2-oxabicyclo[2.2.1]heptan-3-one
Also Known As: Oprea1_609881|1-[(4-benzylpiperidin-1-yl)carbonyl]-4,7,7-trimethyl-2-oxabicyclo[2.2.1]heptan-3-one|(1S,4S)-1-(4-BENZYLPIPERIDINE-1-CARBONYL)-4,7,7-TRIMETHYL-2-OXABICYCLO[2.2.1]HEPTAN-3-ONE|1,7,7-trimethyl-4-{[4-benzylpiperidyl]carbonyl}-3-oxabicyclo[2.2.1]heptan-2-on e|4-(4-benzylpiperidine-1-carbonyl)-1,7,7-trimethyl-3-oxabicyclo[2.2.1]heptan-2-one
| Molecular Formula | C22H29NO3 |
|---|---|
| Molecular Weight | 355.21475 g/mol |
| LogP | 3.5896 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 355.21475 |
| Monoisotopic Mass | 355.21475 |
| Heavy Atoms | 26 |
| Complexity | 720.1627 |
Chemical Identifiers
| CAS Number | 613658-59-6 |
|---|---|
| SMILES | CC1(C2(CCC1(OC2=O)C(=O)N3CCC(CC3)CC4=CC=CC=C4)C)C |
Product Overview
AC1NAQ1E (CAS 613658-59-6), with molecular formula C22H29NO3 and molecular weight 355.21475 g/mol. IUPAC: 1-(4-benzylpiperidine-1-carbonyl)-4,7,7-trimethyl-2-oxabicyclo[2.2.1]heptan-3-one.
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