4-(4-Phenylpiperidin-4-ylcarbonyl)morpholine hydrochloride

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Basic information

CAS: 83929-37-7
Standard SMILES: O=C(N1CCOCC1)C1(c2ccccc2)CCNCC1
InChIKey: KSXVHBMVDLMAQG-UHFFFAOYSA-N
Molecular formula: C16H22N2O2
Average molar mass: 274.36 g/mol
Monoisotopic mass: 274.16812795

Names & identifiers

Preferred name: 4-(4-Phenylpiperidin-4-ylcarbonyl)morpholine hydrochloride
IUPAC: morpholin-4-yl-(4-phenylpiperidin-4-yl)methanone

Names & synonyms

83929-37-74-(4-Phenylpiperidin-4-ylcarbonyl)morpholine hydrochlorideEINECS 281-333-0NSC 163376DTXSID70232816RefChem:97270DTXCID00155307281-333-0Morpholino(4-phenylpiperidine-4-yl) ketonemorpholin-4-yl-(4-phenylpiperidin-4-yl)methanoneCHEMBL361064NCI-163376

Show more names

NSC163376NSC-163376NCI60_001237NCIStruc1_001319NCIStruc2_001956SCHEMBL373284SCHEMBL8327261KSXVHBMVDLMAQG-UHFFFAOYSA-N

Database identifiers

CAS: 83929-37-7
PubChem CID: 424326
ChEMBL: CHEMBL361064
EC Number: 281-333-0
Nikkaji: J330.297K

Properties

Computed structural properties

XLogP: 0.9
Topological polar surface area: 41.6 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 2
Heavy atoms: 20
Formal charge: 0
Complexity: 327

Related reactions

2 records

New reaction record

HRID 1670766As productuspto-grants-2011_08

HRID 2342135As productTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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