1-(2,3-dihydrofuran-5-yl)-2-(2-methylphenyl)ethanone

C13H14O2 — CID 102650891

IUPAC1-(2,3-dihydrofuran-5-yl)-2-(2-methylphenyl)ethanone
SMILESCc1ccccc1CC(=O)C1=CCCO1
InChIInChI=1S/C13H14O2/c1-10-5-2-3-6-11(10)9-12(14)13-7-4-8-15-13/h2-3,5-7H,4,8-9H2,1H3
InChIKeyKJIJFOZNWDXPCY-UHFFFAOYSA-N
MW202.25 g/mol
LogP2.41
Rot. Bonds3

About 1-(2,3-dihydrofuran-5-yl)-2-(2-methylphenyl)ethanone

1-(2,3-dihydrofuran-5-yl)-2-(2-methylphenyl)ethanone (PubChem CID 102650891) has the molecular formula C13H14O2 and a molecular weight of 202.25 g/mol. Its IUPAC name is 1-(2,3-dihydrofuran-5-yl)-2-(2-methylphenyl)ethanone.

Molecular Properties

Compound Name1-(2,3-dihydrofuran-5-yl)-2-(2-methylphenyl)ethanone
PubChem CID102650891
Molecular FormulaC13H14O2
Molecular Weight202.25 g/mol
Exact Mass202.10
IUPAC Name1-(2,3-dihydrofuran-5-yl)-2-(2-methylphenyl)ethanone
SMILESCc1ccccc1CC(=O)C1=CCCO1
InChIInChI=1S/C13H14O2/c1-10-5-2-3-6-11(10)9-12(14)13-7-4-8-15-13/h2-3,5-7H,4,8-9H2,1H3
InChIKeyKJIJFOZNWDXPCY-UHFFFAOYSA-N
XLogP2.41
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,3-dihydrofuran-5-yl)-2-(3,4-dimethylphenyl)ethanone
CID 102650916
1-(cyclohexen-1-yl)-2-(2-methylphenyl)ethanone
CID 62077966
1,2-bis(2-methylphenyl)ethanone
CID 11345119
2-(2-methylphenyl)acetic acid
CID 67440217
1-cyclopropyl-2-(2-methylphenyl)ethanone
CID 39236490
1-(3,4-dihydro-2H-chromen-8-yl)-2-(2-methylphenyl)ethanone
CID 114744040
2-(2-methylphenyl)-1-(2,3,5,6-tetramethylphenyl)ethanone
CID 43337311
1-(2,3-dihydrofuran-5-yl)but-3-en-1-one
CID 130171823
2-(2-methylphenyl)-1-pyridazin-4-ylethanone
CID 105079516
1-(4-iodophenyl)-2-(2-methylphenyl)ethanone
CID 43160312
1-(2-aminophenyl)-2-(2-methylphenyl)ethanone
CID 64832569
1-(4-methylcyclohexen-1-yl)-2-(2-methylphenyl)ethanone
CID 103451108

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydrofuran-5-yl)-2-(2-methylphenyl)ethanone?
The IUPAC name of 1-(2,3-dihydrofuran-5-yl)-2-(2-methylphenyl)ethanone (CID 102650891) is 1-(2,3-dihydrofuran-5-yl)-2-(2-methylphenyl)ethanone.
What is the SMILES notation for 1-(2,3-dihydrofuran-5-yl)-2-(2-methylphenyl)ethanone?
The canonical SMILES for 1-(2,3-dihydrofuran-5-yl)-2-(2-methylphenyl)ethanone is Cc1ccccc1CC(=O)C1=CCCO1.
What is the InChIKey of 1-(2,3-dihydrofuran-5-yl)-2-(2-methylphenyl)ethanone?
The InChIKey is KJIJFOZNWDXPCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14O2/c1-10-5-2-3-6-11(10)9-12(14)13-7-4-8-15-13/h2-3,5-7H,4,8-9H2,1H3.
What are the key properties of 1-(2,3-dihydrofuran-5-yl)-2-(2-methylphenyl)ethanone?
1-(2,3-dihydrofuran-5-yl)-2-(2-methylphenyl)ethanone has a molecular weight of 202.25 g/mol, XLogP of 2.41, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydrofuran-5-yl)-2-(2-methylphenyl)ethanone is sourced from PubChem (CID 102650891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).