1-[4-[[4-[(4-acetylphenoxy)methyl]phenyl]methoxy]phenyl]ethanone

C24H22O4 — CID 10619405

IUPAC1-[4-[[4-[(4-acetylphenoxy)methyl]phenyl]methoxy]phenyl]ethanone
SMILESCC(=O)c1ccc(OCc2ccc(COc3ccc(C(C)=O)cc3)cc2)cc1
InChIInChI=1S/C24H22O4/c1-17(25)21-7-11-23(12-8-21)27-15-19-3-5-20(6-4-19)16-28-24-13-9-22(10-14-24)18(2)26/h3-14H,15-16H2,1-2H3
InChIKeyAVEIZDYDGKUFHU-UHFFFAOYSA-N
MW374.44 g/mol
LogP5.25
Rot. Bonds8

About 1-[4-[[4-[(4-acetylphenoxy)methyl]phenyl]methoxy]phenyl]ethanone

1-[4-[[4-[(4-acetylphenoxy)methyl]phenyl]methoxy]phenyl]ethanone (PubChem CID 10619405) has the molecular formula C24H22O4 and a molecular weight of 374.44 g/mol. Its IUPAC name is 1-[4-[[4-[(4-acetylphenoxy)methyl]phenyl]methoxy]phenyl]ethanone.

Molecular Properties

Compound Name1-[4-[[4-[(4-acetylphenoxy)methyl]phenyl]methoxy]phenyl]ethanone
PubChem CID10619405
Molecular FormulaC24H22O4
Molecular Weight374.44 g/mol
Exact Mass374.15
IUPAC Name1-[4-[[4-[(4-acetylphenoxy)methyl]phenyl]methoxy]phenyl]ethanone
SMILESCC(=O)c1ccc(OCc2ccc(COc3ccc(C(C)=O)cc3)cc2)cc1
InChIInChI=1S/C24H22O4/c1-17(25)21-7-11-23(12-8-21)27-15-19-3-5-20(6-4-19)16-28-24-13-9-22(10-14-24)18(2)26/h3-14H,15-16H2,1-2H3
InChIKeyAVEIZDYDGKUFHU-UHFFFAOYSA-N
XLogP5.25
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.44
LogP ≤ 55.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-[(4-butoxyphenoxy)methyl]phenyl]ethanone
CID 2216486
1-[4-[4-[(4-methoxyphenyl)methoxy]phenyl]phenyl]ethanone
CID 14597431
1-[4-[[4-(trifluoromethoxy)phenyl]methoxy]phenyl]ethanone
CID 52561273
N-(4-acetylphenyl)-N'-(4-phenylmethoxyphenyl)oxamide
CID 108987469
4-[[4-(2-oxopropyl)phenoxy]methyl]benzoic acid
CID 115493805
4-[(4-ethylphenoxy)methyl]benzoic acid
CID 585022
5-[(4-acetylphenoxy)methyl]-2-fluorobenzonitrile
CID 103758764
1-[4-(iodomethoxy)phenyl]ethanone
CID 118233287
1-[4-[(5-chloro-3-pyridinyl)methoxy]phenyl]ethanone
CID 59626117
1-[4-(3-phenylmethoxypropoxy)phenyl]ethanone
CID 21110216
2-hydroxy-1-[4-[(4-methylphenyl)methoxy]phenyl]ethanone
CID 170162201
methyl 4-[[4-(hydroxymethyl)phenoxy]methyl]benzoate
CID 23631878

Frequently Asked Questions

What is the IUPAC name of 1-[4-[[4-[(4-acetylphenoxy)methyl]phenyl]methoxy]phenyl]ethanone?
The IUPAC name of 1-[4-[[4-[(4-acetylphenoxy)methyl]phenyl]methoxy]phenyl]ethanone (CID 10619405) is 1-[4-[[4-[(4-acetylphenoxy)methyl]phenyl]methoxy]phenyl]ethanone.
What is the SMILES notation for 1-[4-[[4-[(4-acetylphenoxy)methyl]phenyl]methoxy]phenyl]ethanone?
The canonical SMILES for 1-[4-[[4-[(4-acetylphenoxy)methyl]phenyl]methoxy]phenyl]ethanone is CC(=O)c1ccc(OCc2ccc(COc3ccc(C(C)=O)cc3)cc2)cc1.
What is the InChIKey of 1-[4-[[4-[(4-acetylphenoxy)methyl]phenyl]methoxy]phenyl]ethanone?
The InChIKey is AVEIZDYDGKUFHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22O4/c1-17(25)21-7-11-23(12-8-21)27-15-19-3-5-20(6-4-19)16-28-24-13-9-22(10-14-24)18(2)26/h3-14H,15-16H2,1-2H3.
What are the key properties of 1-[4-[[4-[(4-acetylphenoxy)methyl]phenyl]methoxy]phenyl]ethanone?
1-[4-[[4-[(4-acetylphenoxy)methyl]phenyl]methoxy]phenyl]ethanone has a molecular weight of 374.44 g/mol, XLogP of 5.25, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[[4-[(4-acetylphenoxy)methyl]phenyl]methoxy]phenyl]ethanone is sourced from PubChem (CID 10619405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).