2,3-dihydrofuran-4-yl-(1-methoxycyclobutyl)methanone

C10H14O3 — CID 130579338

IUPAC2,3-dihydrofuran-4-yl-(1-methoxycyclobutyl)methanone
SMILESCOC1(C(=O)C2=COCC2)CCC1
InChIInChI=1S/C10H14O3/c1-12-10(4-2-5-10)9(11)8-3-6-13-7-8/h7H,2-6H2,1H3
InChIKeyQEVIWFKEROTKOG-UHFFFAOYSA-N
MW182.22 g/mol
LogP1.43
Rot. Bonds3

About 2,3-dihydrofuran-4-yl-(1-methoxycyclobutyl)methanone

2,3-dihydrofuran-4-yl-(1-methoxycyclobutyl)methanone (PubChem CID 130579338) has the molecular formula C10H14O3 and a molecular weight of 182.22 g/mol. Its IUPAC name is 2,3-dihydrofuran-4-yl-(1-methoxycyclobutyl)methanone.

Molecular Properties

Compound Name2,3-dihydrofuran-4-yl-(1-methoxycyclobutyl)methanone
PubChem CID130579338
Molecular FormulaC10H14O3
Molecular Weight182.22 g/mol
Exact Mass182.09
IUPAC Name2,3-dihydrofuran-4-yl-(1-methoxycyclobutyl)methanone
SMILESCOC1(C(=O)C2=COCC2)CCC1
InChIInChI=1S/C10H14O3/c1-12-10(4-2-5-10)9(11)8-3-6-13-7-8/h7H,2-6H2,1H3
InChIKeyQEVIWFKEROTKOG-UHFFFAOYSA-N
XLogP1.43
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Cyclobutyl(2,3-dihydrofuran-4-yl)methanone
CID 130579251
2,3-Dihydrofuran-4-yl-(4-methoxyoxan-4-yl)methanone
CID 130579340
1-(2,3-Dihydrofuran-4-yl)-2-hydroxy-2-methylbutan-1-one
CID 130579357

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydrofuran-4-yl-(1-methoxycyclobutyl)methanone?
The IUPAC name of 2,3-dihydrofuran-4-yl-(1-methoxycyclobutyl)methanone (CID 130579338) is 2,3-dihydrofuran-4-yl-(1-methoxycyclobutyl)methanone.
What is the SMILES notation for 2,3-dihydrofuran-4-yl-(1-methoxycyclobutyl)methanone?
The canonical SMILES for 2,3-dihydrofuran-4-yl-(1-methoxycyclobutyl)methanone is COC1(C(=O)C2=COCC2)CCC1.
What is the InChIKey of 2,3-dihydrofuran-4-yl-(1-methoxycyclobutyl)methanone?
The InChIKey is QEVIWFKEROTKOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O3/c1-12-10(4-2-5-10)9(11)8-3-6-13-7-8/h7H,2-6H2,1H3.
What are the key properties of 2,3-dihydrofuran-4-yl-(1-methoxycyclobutyl)methanone?
2,3-dihydrofuran-4-yl-(1-methoxycyclobutyl)methanone has a molecular weight of 182.22 g/mol, XLogP of 1.43, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydrofuran-4-yl-(1-methoxycyclobutyl)methanone is sourced from PubChem (CID 130579338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).