(2S)-2,3-diphenyl-4-propyl-2H-furan-5-one

C19H18O2 — CID 101165719

IUPAC(2S)-2,3-diphenyl-4-propyl-2H-furan-5-one
SMILESCCCC1=C(c2ccccc2)[C@H](c2ccccc2)OC1=O
InChIInChI=1S/C19H18O2/c1-2-9-16-17(14-10-5-3-6-11-14)18(21-19(16)20)15-12-7-4-8-13-15/h3-8,10-13,18H,2,9H2,1H3/t18-/m0/s1
InChIKeyWRSODFJJTWXHPM-SFHVURJKSA-N
MW278.35 g/mol
LogP4.54
Rot. Bonds4

About (2S)-2,3-diphenyl-4-propyl-2H-furan-5-one

(2S)-2,3-diphenyl-4-propyl-2H-furan-5-one (PubChem CID 101165719) has the molecular formula C19H18O2 and a molecular weight of 278.35 g/mol. Its IUPAC name is (2S)-2,3-diphenyl-4-propyl-2H-furan-5-one.

Molecular Properties

Compound Name(2S)-2,3-diphenyl-4-propyl-2H-furan-5-one
PubChem CID101165719
Molecular FormulaC19H18O2
Molecular Weight278.35 g/mol
Exact Mass278.13
IUPAC Name(2S)-2,3-diphenyl-4-propyl-2H-furan-5-one
SMILESCCCC1=C(c2ccccc2)[C@H](c2ccccc2)OC1=O
InChIInChI=1S/C19H18O2/c1-2-9-16-17(14-10-5-3-6-11-14)18(21-19(16)20)15-12-7-4-8-13-15/h3-8,10-13,18H,2,9H2,1H3/t18-/m0/s1
InChIKeyWRSODFJJTWXHPM-SFHVURJKSA-N
XLogP4.54
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 54.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(5-oxo-2-phenyl-4-propyl-2H-furan-3-yl)-2-phenyl-4-propyl-2H-furan-5-one
CID 5250336
3-(5-benzylfuran-3-yl)-2-phenyl-4-propyl-2H-furan-5-one
CID 101185332
2-phenyl-3-prop-2-enyl-4-propyl-2H-furan-5-one
CID 10922728
3-phenyl-2-[(E)-2-phenylethenyl]-4-propyl-2H-furan-5-one
CID 11141244
7,8-diphenyl-5-propyl-3-oxabicyclo[4.2.0]octa-1(8),5-dien-4-one
CID 102323351
(2R)-4-methyl-3-[(2R)-4-methyl-5-oxo-2-phenyl-2H-furan-3-yl]-2-phenyl-2H-furan-5-one
CID 102397882
methyl 5-oxo-2,3-diphenyl-2H-furan-4-carboxylate
CID 70977330
4-[(2R)-5-oxo-2,4-diphenyl-2H-furan-3-yl]benzonitrile
CID 86338758
3-phenyl-4-propyl-2H-furan-5-one
CID 118283591
4,5-diphenyl-2,3-dipropylcyclopent-2-en-1-one
CID 73080839
(3R,6R)-3,6-diphenyl-1,4-dioxane-2,5-dione
CID 101432935
(3R,6S)-3,6-diphenyl-1,4-dioxane-2,5-dione
CID 101432934

Frequently Asked Questions

What is the IUPAC name of (2S)-2,3-diphenyl-4-propyl-2H-furan-5-one?
The IUPAC name of (2S)-2,3-diphenyl-4-propyl-2H-furan-5-one (CID 101165719) is (2S)-2,3-diphenyl-4-propyl-2H-furan-5-one.
What is the SMILES notation for (2S)-2,3-diphenyl-4-propyl-2H-furan-5-one?
The canonical SMILES for (2S)-2,3-diphenyl-4-propyl-2H-furan-5-one is CCCC1=C(c2ccccc2)[C@H](c2ccccc2)OC1=O.
What is the InChIKey of (2S)-2,3-diphenyl-4-propyl-2H-furan-5-one?
The InChIKey is WRSODFJJTWXHPM-SFHVURJKSA-N. The full InChI is InChI=1S/C19H18O2/c1-2-9-16-17(14-10-5-3-6-11-14)18(21-19(16)20)15-12-7-4-8-13-15/h3-8,10-13,18H,2,9H2,1H3/t18-/m0/s1.
What are the key properties of (2S)-2,3-diphenyl-4-propyl-2H-furan-5-one?
(2S)-2,3-diphenyl-4-propyl-2H-furan-5-one has a molecular weight of 278.35 g/mol, XLogP of 4.54, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2,3-diphenyl-4-propyl-2H-furan-5-one is sourced from PubChem (CID 101165719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).