1-(4-methoxy-3-phenylphenyl)ethanone

C15H14O2 — CID 16768795

IUPAC1-(4-methoxy-3-phenylphenyl)ethanone
SMILESCOc1ccc(C(C)=O)cc1-c1ccccc1
InChIInChI=1S/C15H14O2/c1-11(16)13-8-9-15(17-2)14(10-13)12-6-4-3-5-7-12/h3-10H,1-2H3
InChIKeyCDAYYHVTEXXQJQ-UHFFFAOYSA-N
MW226.27 g/mol
LogP3.56
Rot. Bonds3

About 1-(4-methoxy-3-phenylphenyl)ethanone

1-(4-methoxy-3-phenylphenyl)ethanone (PubChem CID 16768795) has the molecular formula C15H14O2 and a molecular weight of 226.27 g/mol. Its IUPAC name is 1-(4-methoxy-3-phenylphenyl)ethanone.

Molecular Properties

Compound Name1-(4-methoxy-3-phenylphenyl)ethanone
PubChem CID16768795
Molecular FormulaC15H14O2
Molecular Weight226.27 g/mol
Exact Mass226.10
IUPAC Name1-(4-methoxy-3-phenylphenyl)ethanone
SMILESCOc1ccc(C(C)=O)cc1-c1ccccc1
InChIInChI=1S/C15H14O2/c1-11(16)13-8-9-15(17-2)14(10-13)12-6-4-3-5-7-12/h3-10H,1-2H3
InChIKeyCDAYYHVTEXXQJQ-UHFFFAOYSA-N
XLogP3.56
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.27
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-3-phenylphenyl)ethanone?
The IUPAC name of 1-(4-methoxy-3-phenylphenyl)ethanone (CID 16768795) is 1-(4-methoxy-3-phenylphenyl)ethanone.
What is the SMILES notation for 1-(4-methoxy-3-phenylphenyl)ethanone?
The canonical SMILES for 1-(4-methoxy-3-phenylphenyl)ethanone is COc1ccc(C(C)=O)cc1-c1ccccc1.
What is the InChIKey of 1-(4-methoxy-3-phenylphenyl)ethanone?
The InChIKey is CDAYYHVTEXXQJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O2/c1-11(16)13-8-9-15(17-2)14(10-13)12-6-4-3-5-7-12/h3-10H,1-2H3.
What are the key properties of 1-(4-methoxy-3-phenylphenyl)ethanone?
1-(4-methoxy-3-phenylphenyl)ethanone has a molecular weight of 226.27 g/mol, XLogP of 3.56, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-3-phenylphenyl)ethanone is sourced from PubChem (CID 16768795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).