2-(furan-3-yl)-1-(oxolan-2-yl)ethanone

C10H12O3 — CID 83171959

IUPAC2-(furan-3-yl)-1-(oxolan-2-yl)ethanone
SMILESO=C(Cc1ccoc1)C1CCCO1
InChIInChI=1S/C10H12O3/c11-9(10-2-1-4-13-10)6-8-3-5-12-7-8/h3,5,7,10H,1-2,4,6H2
InChIKeyURXKGOCNVSIUFZ-UHFFFAOYSA-N
MW180.20 g/mol
LogP1.57
Rot. Bonds3

About 2-(furan-3-yl)-1-(oxolan-2-yl)ethanone

2-(furan-3-yl)-1-(oxolan-2-yl)ethanone (PubChem CID 83171959) has the molecular formula C10H12O3 and a molecular weight of 180.20 g/mol. Its IUPAC name is 2-(furan-3-yl)-1-(oxolan-2-yl)ethanone.

Molecular Properties

Compound Name2-(furan-3-yl)-1-(oxolan-2-yl)ethanone
PubChem CID83171959
Molecular FormulaC10H12O3
Molecular Weight180.20 g/mol
Exact Mass180.08
IUPAC Name2-(furan-3-yl)-1-(oxolan-2-yl)ethanone
SMILESO=C(Cc1ccoc1)C1CCCO1
InChIInChI=1S/C10H12O3/c11-9(10-2-1-4-13-10)6-8-3-5-12-7-8/h3,5,7,10H,1-2,4,6H2
InChIKeyURXKGOCNVSIUFZ-UHFFFAOYSA-N
XLogP1.57
TPSA39.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.20
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methylphenyl)-1-(oxolan-2-yl)ethanone
CID 61080286
2-(furan-3-yl)-1-(5-methyloxolan-2-yl)ethanone
CID 115795921
1-(6-bicyclo[3.1.0]hexanyl)-2-(furan-3-yl)ethanone
CID 115795935
2-(furan-3-yl)-1-(thiolan-2-yl)ethanone
CID 83171419
2-(furan-3-yl)-1-(3-methylcyclopentyl)ethanone
CID 83171833
2-(2-fluorophenyl)-1-(oxolan-2-yl)ethanone
CID 61080279
2-(5-bromofuran-3-yl)-1-(oxan-2-yl)ethanone
CID 131019765
1-(1,1-dioxothian-2-yl)-2-(furan-3-yl)ethanone
CID 115795938
1-[2-(aminomethyl)cyclohexyl]-2-(furan-3-yl)ethanone
CID 116584689
1-cyclobutyl-3-(furan-3-yl)propan-2-one
CID 103168049
2-(furan-3-yl)-1-(5-methyloxolan-3-yl)ethanone
CID 115795793
1-cyclohexyl-3-(furan-3-yl)propan-2-one
CID 115795908

Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-yl)-1-(oxolan-2-yl)ethanone?
The IUPAC name of 2-(furan-3-yl)-1-(oxolan-2-yl)ethanone (CID 83171959) is 2-(furan-3-yl)-1-(oxolan-2-yl)ethanone.
What is the SMILES notation for 2-(furan-3-yl)-1-(oxolan-2-yl)ethanone?
The canonical SMILES for 2-(furan-3-yl)-1-(oxolan-2-yl)ethanone is O=C(Cc1ccoc1)C1CCCO1.
What is the InChIKey of 2-(furan-3-yl)-1-(oxolan-2-yl)ethanone?
The InChIKey is URXKGOCNVSIUFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O3/c11-9(10-2-1-4-13-10)6-8-3-5-12-7-8/h3,5,7,10H,1-2,4,6H2.
What are the key properties of 2-(furan-3-yl)-1-(oxolan-2-yl)ethanone?
2-(furan-3-yl)-1-(oxolan-2-yl)ethanone has a molecular weight of 180.20 g/mol, XLogP of 1.57, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)-1-(oxolan-2-yl)ethanone is sourced from PubChem (CID 83171959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).