2,3-dihydrofuran-5-yl-(3-ethylcyclopentyl)methanone

C12H18O2 — CID 102650982

IUPAC2,3-dihydrofuran-5-yl-(3-ethylcyclopentyl)methanone
SMILESCCC1CCC(C(=O)C2=CCCO2)C1
InChIInChI=1S/C12H18O2/c1-2-9-5-6-10(8-9)12(13)11-4-3-7-14-11/h4,9-10H,2-3,5-8H2,1H3
InChIKeyRBKYEHRMOSKDFX-UHFFFAOYSA-N
MW194.27 g/mol
LogP2.69
Rot. Bonds3

About 2,3-dihydrofuran-5-yl-(3-ethylcyclopentyl)methanone

2,3-dihydrofuran-5-yl-(3-ethylcyclopentyl)methanone (PubChem CID 102650982) has the molecular formula C12H18O2 and a molecular weight of 194.27 g/mol. Its IUPAC name is 2,3-dihydrofuran-5-yl-(3-ethylcyclopentyl)methanone.

Molecular Properties

Compound Name2,3-dihydrofuran-5-yl-(3-ethylcyclopentyl)methanone
PubChem CID102650982
Molecular FormulaC12H18O2
Molecular Weight194.27 g/mol
Exact Mass194.13
IUPAC Name2,3-dihydrofuran-5-yl-(3-ethylcyclopentyl)methanone
SMILESCCC1CCC(C(=O)C2=CCCO2)C1
InChIInChI=1S/C12H18O2/c1-2-9-5-6-10(8-9)12(13)11-4-3-7-14-11/h4,9-10H,2-3,5-8H2,1H3
InChIKeyRBKYEHRMOSKDFX-UHFFFAOYSA-N
XLogP2.69
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.27
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydrofuran-5-yl-(3-ethylcyclopentyl)methanone?
The IUPAC name of 2,3-dihydrofuran-5-yl-(3-ethylcyclopentyl)methanone (CID 102650982) is 2,3-dihydrofuran-5-yl-(3-ethylcyclopentyl)methanone.
What is the SMILES notation for 2,3-dihydrofuran-5-yl-(3-ethylcyclopentyl)methanone?
The canonical SMILES for 2,3-dihydrofuran-5-yl-(3-ethylcyclopentyl)methanone is CCC1CCC(C(=O)C2=CCCO2)C1.
What is the InChIKey of 2,3-dihydrofuran-5-yl-(3-ethylcyclopentyl)methanone?
The InChIKey is RBKYEHRMOSKDFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O2/c1-2-9-5-6-10(8-9)12(13)11-4-3-7-14-11/h4,9-10H,2-3,5-8H2,1H3.
What are the key properties of 2,3-dihydrofuran-5-yl-(3-ethylcyclopentyl)methanone?
2,3-dihydrofuran-5-yl-(3-ethylcyclopentyl)methanone has a molecular weight of 194.27 g/mol, XLogP of 2.69, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydrofuran-5-yl-(3-ethylcyclopentyl)methanone is sourced from PubChem (CID 102650982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).