(4Z)-4-benzylidene-6-phenylpyran-2-one

C18H14O2 — CID 134105973

IUPAC(4Z)-4-benzylidene-6-phenylpyran-2-one
SMILESO=C1C/C(=C/c2ccccc2)C=C(c2ccccc2)O1
InChIInChI=1S/C18H14O2/c19-18-13-15(11-14-7-3-1-4-8-14)12-17(20-18)16-9-5-2-6-10-16/h1-12H,13H2/b15-11+
InChIKeyFEARBJNHXDQSJH-RVDMUPIBSA-N
MW262.31 g/mol
LogP4.06
Rot. Bonds2

About (4Z)-4-benzylidene-6-phenylpyran-2-one

(4Z)-4-benzylidene-6-phenylpyran-2-one (PubChem CID 134105973) has the molecular formula C18H14O2 and a molecular weight of 262.31 g/mol. Its IUPAC name is (4Z)-4-benzylidene-6-phenylpyran-2-one.

Molecular Properties

Compound Name(4Z)-4-benzylidene-6-phenylpyran-2-one
PubChem CID134105973
Molecular FormulaC18H14O2
Molecular Weight262.31 g/mol
Exact Mass262.10
IUPAC Name(4Z)-4-benzylidene-6-phenylpyran-2-one
SMILESO=C1C/C(=C/c2ccccc2)C=C(c2ccccc2)O1
InChIInChI=1S/C18H14O2/c19-18-13-15(11-14-7-3-1-4-8-14)12-17(20-18)16-9-5-2-6-10-16/h1-12H,13H2/b15-11+
InChIKeyFEARBJNHXDQSJH-RVDMUPIBSA-N
XLogP4.06
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-benzylidene-5-phenylfuran
CID 169094346
(3E)-3-benzylidene-5-phenylfuran
CID 175928985
(3Z)-3-[[4-[(Z)-(2-oxo-5-phenylfuran-3-ylidene)methyl]phenyl]methylidene]-5-phenylfuran-2-one
CID 11984182
(3E)-3-[(4-fluorophenyl)methylidene]-5-phenylfuran-2-one
CID 5394659
5-benzylidene-4-phenylfuran-2-one
CID 67301545
(3E)-3-[(3-phenoxyphenyl)methylidene]-5-phenylfuran-2-one
CID 15483513
(2E)-2-benzylidene-1,3-oxazolidin-5-one
CID 70400530
(6Z)-6-benzylideneoxan-2-one
CID 101488172
3-[(4-nitrophenyl)methylidene]-5-(4-phenylphenyl)furan-2-one
CID 2936939
(3E)-3-[(4-ethoxyphenyl)methylidene]-5-phenylfuran-2-one
CID 785278
3-[(4-ethoxyphenyl)methylidene]-5-phenylfuran-2-one
CID 3120319
(3Z)-3-[(2-hydroxyphenyl)methylidene]-5-phenylfuran-2-one
CID 6272528

Frequently Asked Questions

What is the IUPAC name of (4Z)-4-benzylidene-6-phenylpyran-2-one?
The IUPAC name of (4Z)-4-benzylidene-6-phenylpyran-2-one (CID 134105973) is (4Z)-4-benzylidene-6-phenylpyran-2-one.
What is the SMILES notation for (4Z)-4-benzylidene-6-phenylpyran-2-one?
The canonical SMILES for (4Z)-4-benzylidene-6-phenylpyran-2-one is O=C1C/C(=C/c2ccccc2)C=C(c2ccccc2)O1.
What is the InChIKey of (4Z)-4-benzylidene-6-phenylpyran-2-one?
The InChIKey is FEARBJNHXDQSJH-RVDMUPIBSA-N. The full InChI is InChI=1S/C18H14O2/c19-18-13-15(11-14-7-3-1-4-8-14)12-17(20-18)16-9-5-2-6-10-16/h1-12H,13H2/b15-11+.
What are the key properties of (4Z)-4-benzylidene-6-phenylpyran-2-one?
(4Z)-4-benzylidene-6-phenylpyran-2-one has a molecular weight of 262.31 g/mol, XLogP of 4.06, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-4-benzylidene-6-phenylpyran-2-one is sourced from PubChem (CID 134105973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).