2,3-diphenyl-1,4-dioxaspiro[4.5]deca-6,9-dien-8-one

C20H16O3 — CID 10447753

IUPAC2,3-diphenyl-1,4-dioxaspiro[4.5]deca-6,9-dien-8-one
SMILESO=C1C=CC2(C=C1)OC(c1ccccc1)C(c1ccccc1)O2
InChIInChI=1S/C20H16O3/c21-17-11-13-20(14-12-17)22-18(15-7-3-1-4-8-15)19(23-20)16-9-5-2-6-10-16/h1-14,18-19H
InChIKeyVZKIYGGLHUVOMC-UHFFFAOYSA-N
MW304.35 g/mol
LogP3.91
Rot. Bonds2

About 2,3-diphenyl-1,4-dioxaspiro[4.5]deca-6,9-dien-8-one

2,3-diphenyl-1,4-dioxaspiro[4.5]deca-6,9-dien-8-one (PubChem CID 10447753) has the molecular formula C20H16O3 and a molecular weight of 304.35 g/mol. Its IUPAC name is 2,3-diphenyl-1,4-dioxaspiro[4.5]deca-6,9-dien-8-one.

Molecular Properties

Compound Name2,3-diphenyl-1,4-dioxaspiro[4.5]deca-6,9-dien-8-one
PubChem CID10447753
Molecular FormulaC20H16O3
Molecular Weight304.35 g/mol
Exact Mass304.11
IUPAC Name2,3-diphenyl-1,4-dioxaspiro[4.5]deca-6,9-dien-8-one
SMILESO=C1C=CC2(C=C1)OC(c1ccccc1)C(c1ccccc1)O2
InChIInChI=1S/C20H16O3/c21-17-11-13-20(14-12-17)22-18(15-7-3-1-4-8-15)19(23-20)16-9-5-2-6-10-16/h1-14,18-19H
InChIKeyVZKIYGGLHUVOMC-UHFFFAOYSA-N
XLogP3.91
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2,3-diphenyl-1,4-dioxaspiro[4.5]deca-6,9-dien-8-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R,3R)-2,3-diphenyl-1,4-dioxaspiro[4.5]deca-6,9-dien-8-one
CID 10063606
(2R,3R)-7,9-diiodo-2,3-diphenyl-1,4-dioxaspiro[4.5]deca-6,9-dien-8-one
CID 101164824
1,2-dioxaspiro[2.5]octa-4,7-dien-6-one
CID 71337471
4-phenylspiro[4.5]deca-6,9-diene-3,8-dione
CID 15701388
1,4-diphenyl-1,3a,4,6a-tetrahydrofuro[3,4-c]furan-3,6-dione
CID 13310359
2,3,5,6,8,9,11,12,14,15-decakis-phenyl-1,4,7,10,13-pentaoxacyclopentadecane
CID 20606657
(3S,4S)-3,4-diphenyldioxetane
CID 71394517
(4S,5S)-2-methoxy-2-methyl-4,5-diphenyl-1,3-dioxolane
CID 14972315
4-methyl-5-oxo-2-phenyl-2H-furan-3-carboxylic acid
CID 141356262
(5S,7R,8R,9S)-9-chloro-8-hydroxy-7-phenyl-1,6-dioxaspiro[4.4]non-3-en-2-one
CID 127032951
(6R,7S)-6,7-diphenyl-5,8-dioxaspiro[2.6]nonane-4,9-dione
CID 139042269
2-phenyl-1-oxaspiro[2.4]hept-5-en-4-one
CID 132501821

Frequently Asked Questions

What is the IUPAC name of 2,3-diphenyl-1,4-dioxaspiro[4.5]deca-6,9-dien-8-one?
The IUPAC name of 2,3-diphenyl-1,4-dioxaspiro[4.5]deca-6,9-dien-8-one (CID 10447753) is 2,3-diphenyl-1,4-dioxaspiro[4.5]deca-6,9-dien-8-one.
What is the SMILES notation for 2,3-diphenyl-1,4-dioxaspiro[4.5]deca-6,9-dien-8-one?
The canonical SMILES for 2,3-diphenyl-1,4-dioxaspiro[4.5]deca-6,9-dien-8-one is O=C1C=CC2(C=C1)OC(c1ccccc1)C(c1ccccc1)O2.
What is the InChIKey of 2,3-diphenyl-1,4-dioxaspiro[4.5]deca-6,9-dien-8-one?
The InChIKey is VZKIYGGLHUVOMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16O3/c21-17-11-13-20(14-12-17)22-18(15-7-3-1-4-8-15)19(23-20)16-9-5-2-6-10-16/h1-14,18-19H.
What are the key properties of 2,3-diphenyl-1,4-dioxaspiro[4.5]deca-6,9-dien-8-one?
2,3-diphenyl-1,4-dioxaspiro[4.5]deca-6,9-dien-8-one has a molecular weight of 304.35 g/mol, XLogP of 3.91, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-diphenyl-1,4-dioxaspiro[4.5]deca-6,9-dien-8-one is sourced from PubChem (CID 10447753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).