1-(4-fluorophenyl)-3-[(2R)-2-[(2R)-oxolan-2-yl]morpholin-4-yl]propan-1-one

C17H22FNO3 — CID 124776743

IUPAC1-(4-fluorophenyl)-3-[(2R)-2-[(2R)-oxolan-2-yl]morpholin-4-yl]propan-1-one
SMILESO=C(CCN1CCO[C@@H]([C@H]2CCCO2)C1)c1ccc(F)cc1
InChIInChI=1S/C17H22FNO3/c18-14-5-3-13(4-6-14)15(20)7-8-19-9-11-22-17(12-19)16-2-1-10-21-16/h3-6,16-17H,1-2,7-12H2/t16-,17-/m1/s1
InChIKeyDBTWMZIKTQMISW-IAGOWNOFSA-N
MW307.36 g/mol
LogP2.28
Rot. Bonds5

About 1-(4-fluorophenyl)-3-[(2R)-2-[(2R)-oxolan-2-yl]morpholin-4-yl]propan-1-one

1-(4-fluorophenyl)-3-[(2R)-2-[(2R)-oxolan-2-yl]morpholin-4-yl]propan-1-one (PubChem CID 124776743) has the molecular formula C17H22FNO3 and a molecular weight of 307.36 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-3-[(2R)-2-[(2R)-oxolan-2-yl]morpholin-4-yl]propan-1-one.

Molecular Properties

Compound Name1-(4-fluorophenyl)-3-[(2R)-2-[(2R)-oxolan-2-yl]morpholin-4-yl]propan-1-one
PubChem CID124776743
Molecular FormulaC17H22FNO3
Molecular Weight307.36 g/mol
Exact Mass307.16
IUPAC Name1-(4-fluorophenyl)-3-[(2R)-2-[(2R)-oxolan-2-yl]morpholin-4-yl]propan-1-one
SMILESO=C(CCN1CCO[C@@H]([C@H]2CCCO2)C1)c1ccc(F)cc1
InChIInChI=1S/C17H22FNO3/c18-14-5-3-13(4-6-14)15(20)7-8-19-9-11-22-17(12-19)16-2-1-10-21-16/h3-6,16-17H,1-2,7-12H2/t16-,17-/m1/s1
InChIKeyDBTWMZIKTQMISW-IAGOWNOFSA-N
XLogP2.28
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.36
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-(4-fluorophenyl)-3-[(2R)-2-[(2R)-oxolan-2-yl]morpholin-4-yl]propan-1-one with MolForge

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Related Compounds

N-(3-fluorophenyl)-3-[(2R)-2-[(2S)-oxolan-2-yl]morpholin-4-yl]propanamide
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(2R)-4-[(2-chloro-5-fluorophenyl)methyl]-2-[(2R)-oxolan-2-yl]morpholine
CID 124830182
N-ethyl-1-[3-(4-fluorophenyl)-3-oxopropyl]piperidine-3-carboxamide
CID 75472604
1-[(3S)-1-[3-(4-fluorophenyl)-3-oxopropyl]piperidin-3-yl]pyrrolidin-2-one
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1-(4-bromophenyl)-3-[2-(4-bromophenyl)morpholin-4-yl]propan-1-one
CID 10766089
3-[2-(hydroxymethyl)morpholin-4-yl]-1-(4-methylphenyl)propan-1-one
CID 81214433
3-(1,1-dioxo-1,4-thiazinan-4-yl)-1-(4-fluorophenyl)propan-1-one
CID 43793154
7-[3-[3-(4-fluorophenyl)pyrrolidin-1-yl]propanoyl]-2,3-dihydrochromen-4-one
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3-(2-methyl-1,4-oxazepan-4-yl)-1-(4-methylphenyl)propan-1-one
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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-3-[(2R)-2-[(2R)-oxolan-2-yl]morpholin-4-yl]propan-1-one?
The IUPAC name of 1-(4-fluorophenyl)-3-[(2R)-2-[(2R)-oxolan-2-yl]morpholin-4-yl]propan-1-one (CID 124776743) is 1-(4-fluorophenyl)-3-[(2R)-2-[(2R)-oxolan-2-yl]morpholin-4-yl]propan-1-one.
What is the SMILES notation for 1-(4-fluorophenyl)-3-[(2R)-2-[(2R)-oxolan-2-yl]morpholin-4-yl]propan-1-one?
The canonical SMILES for 1-(4-fluorophenyl)-3-[(2R)-2-[(2R)-oxolan-2-yl]morpholin-4-yl]propan-1-one is O=C(CCN1CCO[C@@H]([C@H]2CCCO2)C1)c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-3-[(2R)-2-[(2R)-oxolan-2-yl]morpholin-4-yl]propan-1-one?
The InChIKey is DBTWMZIKTQMISW-IAGOWNOFSA-N. The full InChI is InChI=1S/C17H22FNO3/c18-14-5-3-13(4-6-14)15(20)7-8-19-9-11-22-17(12-19)16-2-1-10-21-16/h3-6,16-17H,1-2,7-12H2/t16-,17-/m1/s1.
What are the key properties of 1-(4-fluorophenyl)-3-[(2R)-2-[(2R)-oxolan-2-yl]morpholin-4-yl]propan-1-one?
1-(4-fluorophenyl)-3-[(2R)-2-[(2R)-oxolan-2-yl]morpholin-4-yl]propan-1-one has a molecular weight of 307.36 g/mol, XLogP of 2.28, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-3-[(2R)-2-[(2R)-oxolan-2-yl]morpholin-4-yl]propan-1-one is sourced from PubChem (CID 124776743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).