6-methyl-4,5-diphenylpyran-2-one

C18H14O2 — CID 71359580

IUPAC6-methyl-4,5-diphenylpyran-2-one
SMILESCc1oc(=O)cc(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C18H14O2/c1-13-18(15-10-6-3-7-11-15)16(12-17(19)20-13)14-8-4-2-5-9-14/h2-12H,1H3
InChIKeyWVETXRHPYKLWAI-UHFFFAOYSA-N
MW262.31 g/mol
LogP4.28
Rot. Bonds2

About 6-methyl-4,5-diphenylpyran-2-one

6-methyl-4,5-diphenylpyran-2-one (PubChem CID 71359580) has the molecular formula C18H14O2 and a molecular weight of 262.31 g/mol. Its IUPAC name is 6-methyl-4,5-diphenylpyran-2-one.

Molecular Properties

Compound Name6-methyl-4,5-diphenylpyran-2-one
PubChem CID71359580
Molecular FormulaC18H14O2
Molecular Weight262.31 g/mol
Exact Mass262.10
IUPAC Name6-methyl-4,5-diphenylpyran-2-one
SMILESCc1oc(=O)cc(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C18H14O2/c1-13-18(15-10-6-3-7-11-15)16(12-17(19)20-13)14-8-4-2-5-9-14/h2-12H,1H3
InChIKeyWVETXRHPYKLWAI-UHFFFAOYSA-N
XLogP4.28
TPSA30.21 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 ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-4,5-diphenylpyran-2-one?
The IUPAC name of 6-methyl-4,5-diphenylpyran-2-one (CID 71359580) is 6-methyl-4,5-diphenylpyran-2-one.
What is the SMILES notation for 6-methyl-4,5-diphenylpyran-2-one?
The canonical SMILES for 6-methyl-4,5-diphenylpyran-2-one is Cc1oc(=O)cc(-c2ccccc2)c1-c1ccccc1.
What is the InChIKey of 6-methyl-4,5-diphenylpyran-2-one?
The InChIKey is WVETXRHPYKLWAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14O2/c1-13-18(15-10-6-3-7-11-15)16(12-17(19)20-13)14-8-4-2-5-9-14/h2-12H,1H3.
What are the key properties of 6-methyl-4,5-diphenylpyran-2-one?
6-methyl-4,5-diphenylpyran-2-one has a molecular weight of 262.31 g/mol, XLogP of 4.28, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4,5-diphenylpyran-2-one is sourced from PubChem (CID 71359580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).