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

C11H16O2 — CID 102650981

IUPAC2,3-dihydrofuran-5-yl-(3-methylcyclopentyl)methanone
SMILESCC1CCC(C(=O)C2=CCCO2)C1
InChIInChI=1S/C11H16O2/c1-8-4-5-9(7-8)11(12)10-3-2-6-13-10/h3,8-9H,2,4-7H2,1H3
InChIKeyAEOGQKVLBFZRFH-UHFFFAOYSA-N
MW180.25 g/mol
LogP2.30
Rot. Bonds2

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

2,3-dihydrofuran-5-yl-(3-methylcyclopentyl)methanone (PubChem CID 102650981) has the molecular formula C11H16O2 and a molecular weight of 180.25 g/mol. Its IUPAC name is 2,3-dihydrofuran-5-yl-(3-methylcyclopentyl)methanone.

Molecular Properties

Compound Name2,3-dihydrofuran-5-yl-(3-methylcyclopentyl)methanone
PubChem CID102650981
Molecular FormulaC11H16O2
Molecular Weight180.25 g/mol
Exact Mass180.12
IUPAC Name2,3-dihydrofuran-5-yl-(3-methylcyclopentyl)methanone
SMILESCC1CCC(C(=O)C2=CCCO2)C1
InChIInChI=1S/C11H16O2/c1-8-4-5-9(7-8)11(12)10-3-2-6-13-10/h3,8-9H,2,4-7H2,1H3
InChIKeyAEOGQKVLBFZRFH-UHFFFAOYSA-N
XLogP2.30
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 ≤ 52.30
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
2,5-Cyclohexadiene-1,4-dione, 2-(2-ethylbutyl)-6-methoxy-
CID 183883
(3,3-Difluorocyclopentyl)-(2,3-dihydrofuran-5-yl)methanone
CID 130484849
Asperterrein
CID 145720735
2-Methoxy-6-(2-methylbutyl)cyclohexa-2,5-diene-1,4-dione
CID 550365
6-Ethoxy-1,2,3,4-tetrahydro-1,4-methanonaphthalene-5,8-dione
CID 91735351
1,2,3,4-Tetrahydro-6-methoxy-1,4-methanonaphthalene-5,8-dione
CID 19710589
5-Ethyl-2-methyl-4-(3-methylbutoxy)-2-(3-methylbutyl)furan-3-one
CID 21465701
2-Ethyl-5-methyl-4-(3-methylbutoxy)-2-(3-methylbutyl)furan-3-one
CID 21465747
2-(6-Methylheptoxy)cyclohex-2-en-1-one
CID 170711358

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydrofuran-5-yl-(3-methylcyclopentyl)methanone?
The IUPAC name of 2,3-dihydrofuran-5-yl-(3-methylcyclopentyl)methanone (CID 102650981) is 2,3-dihydrofuran-5-yl-(3-methylcyclopentyl)methanone.
What is the SMILES notation for 2,3-dihydrofuran-5-yl-(3-methylcyclopentyl)methanone?
The canonical SMILES for 2,3-dihydrofuran-5-yl-(3-methylcyclopentyl)methanone is CC1CCC(C(=O)C2=CCCO2)C1.
What is the InChIKey of 2,3-dihydrofuran-5-yl-(3-methylcyclopentyl)methanone?
The InChIKey is AEOGQKVLBFZRFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O2/c1-8-4-5-9(7-8)11(12)10-3-2-6-13-10/h3,8-9H,2,4-7H2,1H3.
What are the key properties of 2,3-dihydrofuran-5-yl-(3-methylcyclopentyl)methanone?
2,3-dihydrofuran-5-yl-(3-methylcyclopentyl)methanone has a molecular weight of 180.25 g/mol, XLogP of 2.30, 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-(3-methylcyclopentyl)methanone is sourced from PubChem (CID 102650981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).