1-(4-Methylphenyl)-3-(piperidin-1-yl)pyrrolidin-2-one
Basic information
- CAS
5378-68-7- Standard SMILES
Cc1ccc(N2CCC(N3CCCCC3)C2=O)cc1- InChIKey
WVIDHXRYTCCXBY-UHFFFAOYSA-N- Molecular formula
- C16H22N2O
- Average molar mass
- 258.36 g/mol
- Monoisotopic mass
- 258.17321333
Names & identifiers
- Preferred name
- 1-(4-Methylphenyl)-3-(piperidin-1-yl)pyrrolidin-2-one
- IUPAC
- 1-(4-methylphenyl)-3-piperidin-1-ylpyrrolidin-2-one
- English name
- 1-(4-Methylphenyl)-3-(1-piperidinyl)pyrrolidin-2-one
- Molecular weight
- 0
Names & synonyms
5378-68-71-(4-methylphenyl)-3-(piperidin-1-yl)pyrrolidin-2-oneDTXSID50968565RefChem:1054446DTXCID401396139BRN 04862643-Piperidino-1-(p-tolyl)-2-pyrrolidinone2-Pyrrolidinone, 3-piperidino-1-(p-tolyl)-1-(4-Methylphenyl)-3-(1-piperidinyl)pyrrolidin-2-one
Database identifiers
- CAS
5378-68-7- PubChem CID
- 110648
- DTXSID
DTXSID50968565- Nikkaji
- J51.480B
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 317
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Related reactions
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Compound notes
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