5-Hydroxy-2-(3-pyrrolidinylcarbonylphenyl)pyridine

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Basic information

CAS: 1261963-28-3
Standard SMILES: O=C(c1cccc(-c2ccc(O)cn2)c1)N1CCCC1
InChIKey: PIHOIRRSBZNTHU-UHFFFAOYSA-N
Molecular formula: C16H16N2O2
Average molar mass: 268.31 g/mol
Monoisotopic mass: 268.12117776

Names & identifiers

Preferred name: 5-Hydroxy-2-(3-pyrrolidinylcarbonylphenyl)pyridine
IUPAC: [3-(5-hydroxy-2-pyridinyl)phenyl]-pyrrolidin-1-ylmethanone

Names & synonyms

1261963-28-3MFCD183237995-HYDROXY-2-(3-PYRROLIDINYLCARBONYLPHENYL)PYRIDINEDTXSID906927765-Hydroxy-2-(3-pyrrolidinylcarbonylphenyl)pyridine, 95%[3-(5-hydroxy-2-pyridyl)phenyl]-pyrrolidin-1-yl-methanone[3-(5-hydroxypyridin-2-yl)phenyl]-pyrrolidin-1-ylmethanone[3-(5-Hydroxypyridin-2-yl)phenyl](pyrrolidin-1-yl)methanone

Database identifiers

CAS: 1261963-28-3
PubChem CID: 53229652
DTXSID: DTXSID90692776

Properties

Computed structural properties

XLogP: 2.1
Topological polar surface area: 53.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 2
Heavy atoms: 20
Formal charge: 0
Complexity: 341

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Compound notes

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