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

C12H16O2 — CID 83171833

IUPAC2-(furan-3-yl)-1-(3-methylcyclopentyl)ethanone
SMILESCC1CCC(C(=O)Cc2ccoc2)C1
InChIInChI=1S/C12H16O2/c1-9-2-3-11(6-9)12(13)7-10-4-5-14-8-10/h4-5,8-9,11H,2-3,6-7H2,1H3
InChIKeyOSZWKENXUVBUON-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.83
Rot. Bonds3

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

2-(furan-3-yl)-1-(3-methylcyclopentyl)ethanone (PubChem CID 83171833) has the molecular formula C12H16O2 and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-(furan-3-yl)-1-(3-methylcyclopentyl)ethanone.

Molecular Properties

Compound Name2-(furan-3-yl)-1-(3-methylcyclopentyl)ethanone
PubChem CID83171833
Molecular FormulaC12H16O2
Molecular Weight192.26 g/mol
Exact Mass192.12
IUPAC Name2-(furan-3-yl)-1-(3-methylcyclopentyl)ethanone
SMILESCC1CCC(C(=O)Cc2ccoc2)C1
InChIInChI=1S/C12H16O2/c1-9-2-3-11(6-9)12(13)7-10-4-5-14-8-10/h4-5,8-9,11H,2-3,6-7H2,1H3
InChIKeyOSZWKENXUVBUON-UHFFFAOYSA-N
XLogP2.83
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(furan-3-yl)-1-(5-methyloxolan-3-yl)ethanone
CID 115795793
2-(4-iodophenyl)-1-(3-methylcyclopentyl)ethanone
CID 65476464
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
1-cyclopropyl-3-(furan-3-yl)propan-1-one
CID 64504771
2-(furan-3-yl)-1-(oxolan-2-yl)ethanone
CID 83171959
2-(4-ethylphenyl)-1-(3-methylcyclohexyl)ethanone
CID 63409929
2-(furan-3-ylmethyl)-4-methylcyclohexan-1-amine
CID 83172878
2-(furan-3-yl)-1-(thiolan-2-yl)ethanone
CID 83171419
furan-3-yl-(4-methylcyclohexyl)methanone
CID 63947942
3-cyclopropyl-1-(furan-3-yl)butan-2-one
CID 115795878
2-(2,5-difluorophenyl)-1-(3-methylcyclopentyl)ethanone
CID 65402969

Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-yl)-1-(3-methylcyclopentyl)ethanone?
The IUPAC name of 2-(furan-3-yl)-1-(3-methylcyclopentyl)ethanone (CID 83171833) is 2-(furan-3-yl)-1-(3-methylcyclopentyl)ethanone.
What is the SMILES notation for 2-(furan-3-yl)-1-(3-methylcyclopentyl)ethanone?
The canonical SMILES for 2-(furan-3-yl)-1-(3-methylcyclopentyl)ethanone is CC1CCC(C(=O)Cc2ccoc2)C1.
What is the InChIKey of 2-(furan-3-yl)-1-(3-methylcyclopentyl)ethanone?
The InChIKey is OSZWKENXUVBUON-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O2/c1-9-2-3-11(6-9)12(13)7-10-4-5-14-8-10/h4-5,8-9,11H,2-3,6-7H2,1H3.
What are the key properties of 2-(furan-3-yl)-1-(3-methylcyclopentyl)ethanone?
2-(furan-3-yl)-1-(3-methylcyclopentyl)ethanone has a molecular weight of 192.26 g/mol, XLogP of 2.83, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)-1-(3-methylcyclopentyl)ethanone is sourced from PubChem (CID 83171833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).