2-(4-methoxyphenyl)-2-(5-methylfuran-2-yl)-1,2-diphenylethanone

C26H22O3 — CID 102309823

IUPAC2-(4-methoxyphenyl)-2-(5-methylfuran-2-yl)-1,2-diphenylethanone
SMILESCOc1ccc(C(C(=O)c2ccccc2)(c2ccccc2)c2ccc(C)o2)cc1
InChIInChI=1S/C26H22O3/c1-19-13-18-24(29-19)26(21-11-7-4-8-12-21,22-14-16-23(28-2)17-15-22)25(27)20-9-5-3-6-10-20/h3-18H,1-2H3
InChIKeyNNOGOLPHBMPCAC-UHFFFAOYSA-N
MW382.46 g/mol
LogP5.81
Rot. Bonds6

About 2-(4-methoxyphenyl)-2-(5-methylfuran-2-yl)-1,2-diphenylethanone

2-(4-methoxyphenyl)-2-(5-methylfuran-2-yl)-1,2-diphenylethanone (PubChem CID 102309823) has the molecular formula C26H22O3 and a molecular weight of 382.46 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-2-(5-methylfuran-2-yl)-1,2-diphenylethanone.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-2-(5-methylfuran-2-yl)-1,2-diphenylethanone
PubChem CID102309823
Molecular FormulaC26H22O3
Molecular Weight382.46 g/mol
Exact Mass382.16
IUPAC Name2-(4-methoxyphenyl)-2-(5-methylfuran-2-yl)-1,2-diphenylethanone
SMILESCOc1ccc(C(C(=O)c2ccccc2)(c2ccccc2)c2ccc(C)o2)cc1
InChIInChI=1S/C26H22O3/c1-19-13-18-24(29-19)26(21-11-7-4-8-12-21,22-14-16-23(28-2)17-15-22)25(27)20-9-5-3-6-10-20/h3-18H,1-2H3
InChIKeyNNOGOLPHBMPCAC-UHFFFAOYSA-N
XLogP5.81
TPSA39.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500382.46
LogP ≤ 55.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(4-methoxyphenyl)-2-(5-methylfuran-2-yl)-1,2-diphenylethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-methylphenyl)-1,2,2-triphenylethanone
CID 122207100
2-chloro-2-(4-methoxyphenyl)-3-oxo-3-phenylpropanoic acid
CID 175409188
2-(4-methoxyphenyl)-2-(4-methylphenyl)-2-phenylacetamide
CID 121405860
2-hydroxy-1,2-bis(4-methoxyphenyl)-3-phenylpropan-1-one
CID 12559074
1-hydroxy-1-(4-methoxyphenyl)-1-phenylpropan-2-one
CID 141100176
1-(4-methoxyphenyl)-1,2,2-triphenylethane-1,2-diol
CID 70611668
methoxymethyl 3-(4-methoxyphenyl)-2-methyl-3-oxo-2-phenylpropanoate
CID 174505893
2-bromo-1,2-bis(4-methoxyphenyl)propan-1-one
CID 129261159
2-(4-methoxyphenoxy)-1,2-diphenylethanone
CID 20722156
[4-[1,1-dimethoxy-2-(4-methoxyphenyl)-2-oxoethyl]phenyl]-diphenylsulfanium
CID 153448773
N-(4-methoxyphenyl)-N'-[2-(4-methoxyphenyl)-2,2-bis(4-methylphenyl)acetyl]benzohydrazide
CID 5131377
(2S,3S)-2,3-dihydroxy-2,3-bis(4-methoxybenzoyl)butanedioic acid
CID 66875563

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-2-(5-methylfuran-2-yl)-1,2-diphenylethanone?
The IUPAC name of 2-(4-methoxyphenyl)-2-(5-methylfuran-2-yl)-1,2-diphenylethanone (CID 102309823) is 2-(4-methoxyphenyl)-2-(5-methylfuran-2-yl)-1,2-diphenylethanone.
What is the SMILES notation for 2-(4-methoxyphenyl)-2-(5-methylfuran-2-yl)-1,2-diphenylethanone?
The canonical SMILES for 2-(4-methoxyphenyl)-2-(5-methylfuran-2-yl)-1,2-diphenylethanone is COc1ccc(C(C(=O)c2ccccc2)(c2ccccc2)c2ccc(C)o2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-2-(5-methylfuran-2-yl)-1,2-diphenylethanone?
The InChIKey is NNOGOLPHBMPCAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22O3/c1-19-13-18-24(29-19)26(21-11-7-4-8-12-21,22-14-16-23(28-2)17-15-22)25(27)20-9-5-3-6-10-20/h3-18H,1-2H3.
What are the key properties of 2-(4-methoxyphenyl)-2-(5-methylfuran-2-yl)-1,2-diphenylethanone?
2-(4-methoxyphenyl)-2-(5-methylfuran-2-yl)-1,2-diphenylethanone has a molecular weight of 382.46 g/mol, XLogP of 5.81, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-2-(5-methylfuran-2-yl)-1,2-diphenylethanone is sourced from PubChem (CID 102309823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).