1-(6-bicyclo[3.1.0]hexanyl)-2-(furan-3-yl)ethanone

C12H14O2 — CID 115795935

IUPAC1-(6-bicyclo[3.1.0]hexanyl)-2-(furan-3-yl)ethanone
SMILESO=C(Cc1ccoc1)C1C2CCCC21
InChIInChI=1S/C12H14O2/c13-11(6-8-4-5-14-7-8)12-9-2-1-3-10(9)12/h4-5,7,9-10,12H,1-3,6H2
InChIKeyKBLHKHSCWFGBPV-UHFFFAOYSA-N
MW190.24 g/mol
LogP2.44
Rot. Bonds3

About 1-(6-bicyclo[3.1.0]hexanyl)-2-(furan-3-yl)ethanone

1-(6-bicyclo[3.1.0]hexanyl)-2-(furan-3-yl)ethanone (PubChem CID 115795935) has the molecular formula C12H14O2 and a molecular weight of 190.24 g/mol. Its IUPAC name is 1-(6-bicyclo[3.1.0]hexanyl)-2-(furan-3-yl)ethanone.

Molecular Properties

Compound Name1-(6-bicyclo[3.1.0]hexanyl)-2-(furan-3-yl)ethanone
PubChem CID115795935
Molecular FormulaC12H14O2
Molecular Weight190.24 g/mol
Exact Mass190.10
IUPAC Name1-(6-bicyclo[3.1.0]hexanyl)-2-(furan-3-yl)ethanone
SMILESO=C(Cc1ccoc1)C1C2CCCC21
InChIInChI=1S/C12H14O2/c13-11(6-8-4-5-14-7-8)12-9-2-1-3-10(9)12/h4-5,7,9-10,12H,1-3,6H2
InChIKeyKBLHKHSCWFGBPV-UHFFFAOYSA-N
XLogP2.44
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.24
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(6-bicyclo[3.1.0]hexanyl)-2-(furan-3-yl)ethanone with MolForge

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Related Compounds

2-(furan-3-yl)-1-(oxolan-2-yl)ethanone
CID 83171959
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-(thiolan-2-yl)ethanone
CID 83171419
6-bicyclo[3.1.0]hexanyl(furan-3-yl)methanone
CID 114971785
2-(furan-3-yl)-1-(5-methyloxolan-2-yl)ethanone
CID 115795921
2-(furan-3-yl)-1-(3-methylcyclopentyl)ethanone
CID 83171833
1-(1,1-dioxothian-2-yl)-2-(furan-3-yl)ethanone
CID 115795938
1-cyclohexyl-3-(furan-3-yl)propan-2-one
CID 115795908
2-(furan-3-yl)-1-(5-methyloxolan-3-yl)ethanone
CID 115795793
1-cyclopropyl-3-(furan-3-yl)propan-1-one
CID 64504771
3-cyclopropyl-1-(furan-3-yl)butan-2-one
CID 115795878

Frequently Asked Questions

What is the IUPAC name of 1-(6-bicyclo[3.1.0]hexanyl)-2-(furan-3-yl)ethanone?
The IUPAC name of 1-(6-bicyclo[3.1.0]hexanyl)-2-(furan-3-yl)ethanone (CID 115795935) is 1-(6-bicyclo[3.1.0]hexanyl)-2-(furan-3-yl)ethanone.
What is the SMILES notation for 1-(6-bicyclo[3.1.0]hexanyl)-2-(furan-3-yl)ethanone?
The canonical SMILES for 1-(6-bicyclo[3.1.0]hexanyl)-2-(furan-3-yl)ethanone is O=C(Cc1ccoc1)C1C2CCCC21.
What is the InChIKey of 1-(6-bicyclo[3.1.0]hexanyl)-2-(furan-3-yl)ethanone?
The InChIKey is KBLHKHSCWFGBPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14O2/c13-11(6-8-4-5-14-7-8)12-9-2-1-3-10(9)12/h4-5,7,9-10,12H,1-3,6H2.
What are the key properties of 1-(6-bicyclo[3.1.0]hexanyl)-2-(furan-3-yl)ethanone?
1-(6-bicyclo[3.1.0]hexanyl)-2-(furan-3-yl)ethanone has a molecular weight of 190.24 g/mol, XLogP of 2.44, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-bicyclo[3.1.0]hexanyl)-2-(furan-3-yl)ethanone is sourced from PubChem (CID 115795935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).