6-phenoxy-2,4-diphenyl-4-azaspiro[2.3]hexan-5-one

C23H19NO2 — CID 14870164

IUPAC6-phenoxy-2,4-diphenyl-4-azaspiro[2.3]hexan-5-one
SMILESO=C1C(Oc2ccccc2)C2(CC2c2ccccc2)N1c1ccccc1
InChIInChI=1S/C23H19NO2/c25-22-21(26-19-14-8-3-9-15-19)23(24(22)18-12-6-2-7-13-18)16-20(23)17-10-4-1-5-11-17/h1-15,20-21H,16H2
InChIKeyYWABHSQTBDLRFU-UHFFFAOYSA-N
MW341.41 g/mol
LogP4.41
Rot. Bonds4

About 6-phenoxy-2,4-diphenyl-4-azaspiro[2.3]hexan-5-one

6-phenoxy-2,4-diphenyl-4-azaspiro[2.3]hexan-5-one (PubChem CID 14870164) has the molecular formula C23H19NO2 and a molecular weight of 341.41 g/mol. Its IUPAC name is 6-phenoxy-2,4-diphenyl-4-azaspiro[2.3]hexan-5-one.

Molecular Properties

Compound Name6-phenoxy-2,4-diphenyl-4-azaspiro[2.3]hexan-5-one
PubChem CID14870164
Molecular FormulaC23H19NO2
Molecular Weight341.41 g/mol
Exact Mass341.14
IUPAC Name6-phenoxy-2,4-diphenyl-4-azaspiro[2.3]hexan-5-one
SMILESO=C1C(Oc2ccccc2)C2(CC2c2ccccc2)N1c1ccccc1
InChIInChI=1S/C23H19NO2/c25-22-21(26-19-14-8-3-9-15-19)23(24(22)18-12-6-2-7-13-18)16-20(23)17-10-4-1-5-11-17/h1-15,20-21H,16H2
InChIKeyYWABHSQTBDLRFU-UHFFFAOYSA-N
XLogP4.41
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(4S,5S,7R)-8-benzoyl-4-phenoxy-5,7-diphenyl-2,8-diazatricyclo[7.4.0.02,5]trideca-1(13),9,11-trien-3-one
CID 40736387
(3R,4R)-3-(4-chlorophenoxy)-1-phenyl-5-thia-9-selena-1-azaspiro[3.5]nonan-2-one
CID 71652463
(5S,6S)-6-phenoxy-5-phenyl-4-oxa-1-azabicyclo[3.2.0]heptan-7-one
CID 165351417
(4R,5S,7R)-8-benzoyl-7-(4-chlorophenyl)-4-phenoxy-5-phenyl-2,8-diazatricyclo[7.4.0.02,5]trideca-1(13),9,11-trien-3-one
CID 6566413
(4S,5R,7S)-8-benzoyl-7-(4-methoxyphenyl)-4-phenoxy-5-phenyl-2,8-diazatricyclo[7.4.0.02,5]trideca-1(13),9,11-trien-3-one
CID 40736401
(4R,5S,7S)-7-(2-chlorophenyl)-4-phenoxy-5-phenyl-8-thia-2-azatricyclo[7.4.0.02,5]trideca-1(13),9,11-trien-3-one
CID 40736408
(3R,4S)-1-[2-[(3R,4S)-2-oxo-3-phenoxy-4-phenylazetidin-1-yl]cyclohexyl]-3-phenoxy-4-phenylazetidin-2-one
CID 102208029
8-benzoyl-5-(4-methoxyphenyl)-7-methyl-4-phenoxy-2,8-diazatricyclo[7.4.0.02,5]trideca-1(13),9,11-trien-3-one
CID 11839320
(3S,4R)-1-[2-[(3R,4S)-2-oxo-3-phenoxy-4-phenylazetidin-1-yl]ethyl]-3-phenoxy-4-phenylazetidin-2-one
CID 101075426
1,2,4-triphenyl-5-sulfanylidenepyrazolidin-3-one
CID 3031315
(3S)-1-(2,2-dimethylhydrazinyl)-4,4-dimethyl-3-phenoxyazetidin-2-one
CID 102056076
CID 58662919
CID 58662919

Frequently Asked Questions

What is the IUPAC name of 6-phenoxy-2,4-diphenyl-4-azaspiro[2.3]hexan-5-one?
The IUPAC name of 6-phenoxy-2,4-diphenyl-4-azaspiro[2.3]hexan-5-one (CID 14870164) is 6-phenoxy-2,4-diphenyl-4-azaspiro[2.3]hexan-5-one.
What is the SMILES notation for 6-phenoxy-2,4-diphenyl-4-azaspiro[2.3]hexan-5-one?
The canonical SMILES for 6-phenoxy-2,4-diphenyl-4-azaspiro[2.3]hexan-5-one is O=C1C(Oc2ccccc2)C2(CC2c2ccccc2)N1c1ccccc1.
What is the InChIKey of 6-phenoxy-2,4-diphenyl-4-azaspiro[2.3]hexan-5-one?
The InChIKey is YWABHSQTBDLRFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19NO2/c25-22-21(26-19-14-8-3-9-15-19)23(24(22)18-12-6-2-7-13-18)16-20(23)17-10-4-1-5-11-17/h1-15,20-21H,16H2.
What are the key properties of 6-phenoxy-2,4-diphenyl-4-azaspiro[2.3]hexan-5-one?
6-phenoxy-2,4-diphenyl-4-azaspiro[2.3]hexan-5-one has a molecular weight of 341.41 g/mol, XLogP of 4.41, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-phenoxy-2,4-diphenyl-4-azaspiro[2.3]hexan-5-one is sourced from PubChem (CID 14870164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).