2-(4-methoxyphenyl)-1-(4-phenylmethoxyphenyl)ethanone

C22H20O3 — CID 18923783

IUPAC2-(4-methoxyphenyl)-1-(4-phenylmethoxyphenyl)ethanone
SMILESCOc1ccc(CC(=O)c2ccc(OCc3ccccc3)cc2)cc1
InChIInChI=1S/C22H20O3/c1-24-20-11-7-17(8-12-20)15-22(23)19-9-13-21(14-10-19)25-16-18-5-3-2-4-6-18/h2-14H,15-16H2,1H3
InChIKeyYUFHIWUSDCSMDN-UHFFFAOYSA-N
MW332.40 g/mol
LogP4.70
Rot. Bonds7

About 2-(4-methoxyphenyl)-1-(4-phenylmethoxyphenyl)ethanone

2-(4-methoxyphenyl)-1-(4-phenylmethoxyphenyl)ethanone (PubChem CID 18923783) has the molecular formula C22H20O3 and a molecular weight of 332.40 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-1-(4-phenylmethoxyphenyl)ethanone.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-1-(4-phenylmethoxyphenyl)ethanone
PubChem CID18923783
Molecular FormulaC22H20O3
Molecular Weight332.40 g/mol
Exact Mass332.14
IUPAC Name2-(4-methoxyphenyl)-1-(4-phenylmethoxyphenyl)ethanone
SMILESCOc1ccc(CC(=O)c2ccc(OCc3ccccc3)cc2)cc1
InChIInChI=1S/C22H20O3/c1-24-20-11-7-17(8-12-20)15-22(23)19-9-13-21(14-10-19)25-16-18-5-3-2-4-6-18/h2-14H,15-16H2,1H3
InChIKeyYUFHIWUSDCSMDN-UHFFFAOYSA-N
XLogP4.70
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-methoxy-4-[(4-phenylmethoxyphenoxy)methyl]benzene
CID 12029541
1-[4-[(4-methoxyphenyl)methoxy]phenyl]butan-1-one
CID 134129695
1-[2-hydroxy-4-[(4-methoxyphenyl)methoxy]phenyl]-2-phenylethanone
CID 91871428
methyl 2-(4-phenylmethoxyphenyl)acetate
CID 2756645
2-amino-1-(4-phenylmethoxyphenyl)ethanone
CID 14579463
2-chloro-1-(4-phenylmethoxyphenyl)ethanone
CID 14579462
4-[2-(4-methoxyphenyl)-2-oxoethyl]benzamide
CID 11673420
benzyl 4-(4-methoxyphenyl)-4-oxobutanoate
CID 14321218
4-[(4-methoxyphenoxy)methyl]-N-methyl-N-phenylbenzamide
CID 122195803
4-phenylmethoxybenzoic acid
CID 68896574
1-(4-methoxyphenyl)-2-(4-propylphenyl)ethanone
CID 71380079
1-[3-[(4-methoxyphenyl)methoxy]phenyl]-2-(4-methylphenyl)ethanone;sulfur monoxide
CID 159572663

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-1-(4-phenylmethoxyphenyl)ethanone?
The IUPAC name of 2-(4-methoxyphenyl)-1-(4-phenylmethoxyphenyl)ethanone (CID 18923783) is 2-(4-methoxyphenyl)-1-(4-phenylmethoxyphenyl)ethanone.
What is the SMILES notation for 2-(4-methoxyphenyl)-1-(4-phenylmethoxyphenyl)ethanone?
The canonical SMILES for 2-(4-methoxyphenyl)-1-(4-phenylmethoxyphenyl)ethanone is COc1ccc(CC(=O)c2ccc(OCc3ccccc3)cc2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-1-(4-phenylmethoxyphenyl)ethanone?
The InChIKey is YUFHIWUSDCSMDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20O3/c1-24-20-11-7-17(8-12-20)15-22(23)19-9-13-21(14-10-19)25-16-18-5-3-2-4-6-18/h2-14H,15-16H2,1H3.
What are the key properties of 2-(4-methoxyphenyl)-1-(4-phenylmethoxyphenyl)ethanone?
2-(4-methoxyphenyl)-1-(4-phenylmethoxyphenyl)ethanone has a molecular weight of 332.40 g/mol, XLogP of 4.70, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-1-(4-phenylmethoxyphenyl)ethanone is sourced from PubChem (CID 18923783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).