1-[2-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]ethanone

C17H18O4 — CID 91863953

IUPAC1-[2-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]ethanone
SMILESCOc1ccc(COc2ccc(C(C)=O)c(OC)c2)cc1
InChIInChI=1S/C17H18O4/c1-12(18)16-9-8-15(10-17(16)20-3)21-11-13-4-6-14(19-2)7-5-13/h4-10H,11H2,1-3H3
InChIKeyGZUOMYZUDTVEIW-UHFFFAOYSA-N
MW286.33 g/mol
LogP3.49
Rot. Bonds6

About 1-[2-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]ethanone

1-[2-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]ethanone (PubChem CID 91863953) has the molecular formula C17H18O4 and a molecular weight of 286.33 g/mol. Its IUPAC name is 1-[2-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]ethanone.

Molecular Properties

Compound Name1-[2-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]ethanone
PubChem CID91863953
Molecular FormulaC17H18O4
Molecular Weight286.33 g/mol
Exact Mass286.12
IUPAC Name1-[2-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]ethanone
SMILESCOc1ccc(COc2ccc(C(C)=O)c(OC)c2)cc1
InChIInChI=1S/C17H18O4/c1-12(18)16-9-8-15(10-17(16)20-3)21-11-13-4-6-14(19-2)7-5-13/h4-10H,11H2,1-3H3
InChIKeyGZUOMYZUDTVEIW-UHFFFAOYSA-N
XLogP3.49
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2,4-bis[(4-methoxyphenyl)methoxy]phenyl]ethanone
CID 11280801
1-[4-[(4-chlorophenyl)methoxy]-2-methoxyphenyl]ethanone
CID 91863947
1-[2-amino-4-[(4-methoxyphenyl)methoxy]phenyl]ethanone
CID 91863870
3-[(4-acetyl-3-methoxyphenoxy)methyl]benzoic acid
CID 91863937
1-[2-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]-3,3-bis(methylsulfanyl)prop-2-en-1-one
CID 126484430
4-[(2-acetyl-5-methoxyphenoxy)methyl]benzonitrile
CID 12813703
1-[4,5-difluoro-2-[(4-methoxyphenyl)methoxy]phenyl]ethanone
CID 71248787
2-[2-[(4-acetyl-3-methoxyphenoxy)methyl]phenyl]acetic acid
CID 91863926
(2-acetyl-5-phenylmethoxyphenyl) benzoate
CID 4189871
1-[2-amino-4-[(4-methoxyphenyl)methoxy]-3-methylphenyl]ethanone
CID 163871431
2-hydroxy-4-[(4-methoxyphenyl)methoxy]-N-methylbenzamide
CID 68959972
ethyl 2-methoxy-4-phenylmethoxybenzoate
CID 162133718

Frequently Asked Questions

What is the IUPAC name of 1-[2-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]ethanone?
The IUPAC name of 1-[2-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]ethanone (CID 91863953) is 1-[2-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]ethanone.
What is the SMILES notation for 1-[2-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]ethanone?
The canonical SMILES for 1-[2-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]ethanone is COc1ccc(COc2ccc(C(C)=O)c(OC)c2)cc1.
What is the InChIKey of 1-[2-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]ethanone?
The InChIKey is GZUOMYZUDTVEIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O4/c1-12(18)16-9-8-15(10-17(16)20-3)21-11-13-4-6-14(19-2)7-5-13/h4-10H,11H2,1-3H3.
What are the key properties of 1-[2-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]ethanone?
1-[2-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]ethanone has a molecular weight of 286.33 g/mol, XLogP of 3.49, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]ethanone is sourced from PubChem (CID 91863953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).