3,3-diphenyl-5,6-dihydrocyclopenta[b]furan-2,4-dione

C19H14O3 — CID 71519156

IUPAC3,3-diphenyl-5,6-dihydrocyclopenta[b]furan-2,4-dione
SMILESO=C1CCC2=C1C(c1ccccc1)(c1ccccc1)C(=O)O2
InChIInChI=1S/C19H14O3/c20-15-11-12-16-17(15)19(18(21)22-16,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10H,11-12H2
InChIKeyHQVGXBJWPULIQW-UHFFFAOYSA-N
MW290.32 g/mol
LogP3.15
Rot. Bonds2

About 3,3-diphenyl-5,6-dihydrocyclopenta[b]furan-2,4-dione

3,3-diphenyl-5,6-dihydrocyclopenta[b]furan-2,4-dione (PubChem CID 71519156) has the molecular formula C19H14O3 and a molecular weight of 290.32 g/mol. Its IUPAC name is 3,3-diphenyl-5,6-dihydrocyclopenta[b]furan-2,4-dione.

Molecular Properties

Compound Name3,3-diphenyl-5,6-dihydrocyclopenta[b]furan-2,4-dione
PubChem CID71519156
Molecular FormulaC19H14O3
Molecular Weight290.32 g/mol
Exact Mass290.09
IUPAC Name3,3-diphenyl-5,6-dihydrocyclopenta[b]furan-2,4-dione
SMILESO=C1CCC2=C1C(c1ccccc1)(c1ccccc1)C(=O)O2
InChIInChI=1S/C19H14O3/c20-15-11-12-16-17(15)19(18(21)22-16,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10H,11-12H2
InChIKeyHQVGXBJWPULIQW-UHFFFAOYSA-N
XLogP3.15
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,3-diphenyl-5,6-dihydrocyclopenta[b]furan-2,4-dione?
The IUPAC name of 3,3-diphenyl-5,6-dihydrocyclopenta[b]furan-2,4-dione (CID 71519156) is 3,3-diphenyl-5,6-dihydrocyclopenta[b]furan-2,4-dione.
What is the SMILES notation for 3,3-diphenyl-5,6-dihydrocyclopenta[b]furan-2,4-dione?
The canonical SMILES for 3,3-diphenyl-5,6-dihydrocyclopenta[b]furan-2,4-dione is O=C1CCC2=C1C(c1ccccc1)(c1ccccc1)C(=O)O2.
What is the InChIKey of 3,3-diphenyl-5,6-dihydrocyclopenta[b]furan-2,4-dione?
The InChIKey is HQVGXBJWPULIQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14O3/c20-15-11-12-16-17(15)19(18(21)22-16,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10H,11-12H2.
What are the key properties of 3,3-diphenyl-5,6-dihydrocyclopenta[b]furan-2,4-dione?
3,3-diphenyl-5,6-dihydrocyclopenta[b]furan-2,4-dione has a molecular weight of 290.32 g/mol, XLogP of 3.15, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-diphenyl-5,6-dihydrocyclopenta[b]furan-2,4-dione is sourced from PubChem (CID 71519156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).