1-(4-Hydroxyphenyl)-4-(piperidine-1-carbonyl)pyrrolidin-2-one

HCID 217804

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Basic information

CAS: 39630-17-6
Standard SMILES: O=C(C1CC(=O)N(c2ccc(O)cc2)C1)N1CCCCC1
InChIKey: WQARZQDBCBXXTP-UHFFFAOYSA-N
Molecular formula: C16H20N2O3
Average molar mass: 288.34 g/mol
Monoisotopic mass: 288.1473925

Names & identifiers

Preferred name: 1-(4-Hydroxyphenyl)-4-(piperidine-1-carbonyl)pyrrolidin-2-one
IUPAC: 1-(4-hydroxyphenyl)-4-(piperidine-1-carbonyl)pyrrolidin-2-one

Names & synonyms

1-(4-hydroxyphenyl)-4-(piperidine-1-carbonyl)pyrrolidin-2-one39630-17-6DTXSID40960250RefChem:1054409DTXCID8013881125477-87-2BRN 04312221-((1-(4-Hydroxyphenyl)-5-oxo-3-pyrrolidinyl)carbonyl)piperidinePiperidine, 1-((1-(4-hydroxyphenyl)-5-oxo-3-pyrrolidinyl)carbonyl)-

Database identifiers

CAS: 39630-17-6
PubChem CID: 217804
DTXSID: DTXSID40960250

Properties

Computed structural properties

XLogP: 0.9
Topological polar surface area: 60.9 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 2
Heavy atoms: 21
Formal charge: 0
Complexity: 398

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