2,3-dihydrofuran-5-yl-(1-methylcyclopentyl)methanone

C11H16O2 — CID 102652768

IUPAC2,3-dihydrofuran-5-yl-(1-methylcyclopentyl)methanone
SMILESCC1(C(=O)C2=CCCO2)CCCC1
InChIInChI=1S/C11H16O2/c1-11(6-2-3-7-11)10(12)9-5-4-8-13-9/h5H,2-4,6-8H2,1H3
InChIKeyXZRBQPXNVTUIDJ-UHFFFAOYSA-N
MW180.25 g/mol
LogP2.44
Rot. Bonds2

About 2,3-dihydrofuran-5-yl-(1-methylcyclopentyl)methanone

2,3-dihydrofuran-5-yl-(1-methylcyclopentyl)methanone (PubChem CID 102652768) has the molecular formula C11H16O2 and a molecular weight of 180.25 g/mol. Its IUPAC name is 2,3-dihydrofuran-5-yl-(1-methylcyclopentyl)methanone.

Molecular Properties

Compound Name2,3-dihydrofuran-5-yl-(1-methylcyclopentyl)methanone
PubChem CID102652768
Molecular FormulaC11H16O2
Molecular Weight180.25 g/mol
Exact Mass180.12
IUPAC Name2,3-dihydrofuran-5-yl-(1-methylcyclopentyl)methanone
SMILESCC1(C(=O)C2=CCCO2)CCCC1
InChIInChI=1S/C11H16O2/c1-11(6-2-3-7-11)10(12)9-5-4-8-13-9/h5H,2-4,6-8H2,1H3
InChIKeyXZRBQPXNVTUIDJ-UHFFFAOYSA-N
XLogP2.44
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,4-dihydro-2H-pyran-6-yl-(4,4-dimethylcyclopenten-1-yl)methanone
CID 11321703
1-(4,4-Dimethylcyclopent-1-en-1-yl)-2-ethoxyprop-2-en-1-one
CID 71377796
(3aR,6aR)-2-ethoxy-5,5-dimethyl-3a,4,6,6a-tetrahydropentalen-1-one
CID 101274662
2-ethoxy-3a-methyl-5,6-dihydro-4H-inden-1-one
CID 134933024
(5E)-4-tert-butyl-2-ethoxy-5-ethylidenecyclopent-2-en-1-one
CID 134996474
(3,3-Difluorocyclopentyl)-(2,3-dihydrofuran-5-yl)methanone
CID 130484849
Asperterrein
CID 145720735
2,3-Dimethoxy-9-methylidenespiro[4.4]non-2-en-4-one
CID 121014676
2-Ethoxy-5,5-dimethylcyclohex-2-en-1-one
CID 20507110
4-Butoxy-2-butyl-2-ethyl-5-methylfuran-3-one
CID 21465759
5,5-Dimethyl-2-(2-methylpropoxy)cyclohex-2-en-1-one
CID 21621652
3,5,5-Trimethyl-2-propoxycyclohex-2-en-1-one
CID 68546940

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydrofuran-5-yl-(1-methylcyclopentyl)methanone?
The IUPAC name of 2,3-dihydrofuran-5-yl-(1-methylcyclopentyl)methanone (CID 102652768) is 2,3-dihydrofuran-5-yl-(1-methylcyclopentyl)methanone.
What is the SMILES notation for 2,3-dihydrofuran-5-yl-(1-methylcyclopentyl)methanone?
The canonical SMILES for 2,3-dihydrofuran-5-yl-(1-methylcyclopentyl)methanone is CC1(C(=O)C2=CCCO2)CCCC1.
What is the InChIKey of 2,3-dihydrofuran-5-yl-(1-methylcyclopentyl)methanone?
The InChIKey is XZRBQPXNVTUIDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O2/c1-11(6-2-3-7-11)10(12)9-5-4-8-13-9/h5H,2-4,6-8H2,1H3.
What are the key properties of 2,3-dihydrofuran-5-yl-(1-methylcyclopentyl)methanone?
2,3-dihydrofuran-5-yl-(1-methylcyclopentyl)methanone has a molecular weight of 180.25 g/mol, XLogP of 2.44, 2 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-(1-methylcyclopentyl)methanone is sourced from PubChem (CID 102652768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).