2-(8-Methyl-3,8-diazabicyclo(3.2.1)octan-3-yl)ethyl diphenylacetate
Basic information
- CAS
63978-01-8- Standard SMILES
CN1C2CCC1CN(CCOC(=O)C(c1ccccc1)c1ccccc1)C2- InChIKey
NDSWVTKMCVPUFP-UHFFFAOYSA-N- Molecular formula
- C23H28N2O2
- Average molar mass
- 364.5 g/mol
- Monoisotopic mass
- 364.21507814
Names & identifiers
- Preferred name
- 2-(8-Methyl-3,8-diazabicyclo(3.2.1)octan-3-yl)ethyl diphenylacetate
- IUPAC
- 2-(8-methyl-3,8-diazabicyclo[3.2.1]octan-3-yl)ethyl 2,2-diphenylacetate
- English name
- 8-Methyl-3,8-diazabicyclo[3.2.1]octane-3-ethanol diphenylacetate
- Molecular formula
- C23H28N2O2
- Molecular weight
- 364.48
Names & synonyms
63978-01-8DTXSID909814502-(8-Methyl-3,8-diazabicyclo(3.2.1)octan-3-yl)ethyl diphenylacetate2-(8-Methyl-3,8-diazabicyclo[3.2.1]octan-3-yl)ethyl diphenylacetateRefChem:1061403DTXCID5014087218-Methyl-3,8-diazabicyclo(3.2.1)octane-3-ethanol diphenylacetate8-Methyl-3,8-diazabicyclo[3.2.1]octane-3-ethanol diphenylacetateBRN 0566267BRN 05662543,8-Diazabicyclo(3.2.1)octane-3-ethanol, 8-methyl-, diphenylacetate3,8-Diazabicyclo(3.2.1)octane, 8-(2'-(diphenylacetoxy)ethyl)-3-methyl-
Show more names
Benzeneacetic acid, α-phenyl-, 2-(8-methyl-3,8-diazabicyclo[3.2.1]oct-3-yl)ethyl ester
8-(2'-(Diphenylacetoxy)ethyl)-3-methyl-3,8-diazabicyclo(3.2.1)octaneDB-318453
Database identifiers
- CAS
63978-01-8、63978-02-9- PubChem CID
- 115446
- DTXSID
DTXSID90981450- Nikkaji
- J68.441D
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 453
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Compound notes
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