1-(2,3-dihydrofuran-4-yl)-2-(1-methylcyclopropyl)ethanone

C10H14O2 — CID 130917920

IUPAC1-(2,3-dihydrofuran-4-yl)-2-(1-methylcyclopropyl)ethanone
SMILESCC1(CC(=O)C2=COCC2)CC1
InChIInChI=1S/C10H14O2/c1-10(3-4-10)6-9(11)8-2-5-12-7-8/h7H,2-6H2,1H3
InChIKeyMMLKHJCYMYDGJR-UHFFFAOYSA-N
MW166.22 g/mol
LogP2.05
Rot. Bonds3

About 1-(2,3-dihydrofuran-4-yl)-2-(1-methylcyclopropyl)ethanone

1-(2,3-dihydrofuran-4-yl)-2-(1-methylcyclopropyl)ethanone (PubChem CID 130917920) has the molecular formula C10H14O2 and a molecular weight of 166.22 g/mol. Its IUPAC name is 1-(2,3-dihydrofuran-4-yl)-2-(1-methylcyclopropyl)ethanone.

Molecular Properties

Compound Name1-(2,3-dihydrofuran-4-yl)-2-(1-methylcyclopropyl)ethanone
PubChem CID130917920
Molecular FormulaC10H14O2
Molecular Weight166.22 g/mol
Exact Mass166.10
IUPAC Name1-(2,3-dihydrofuran-4-yl)-2-(1-methylcyclopropyl)ethanone
SMILESCC1(CC(=O)C2=COCC2)CC1
InChIInChI=1S/C10H14O2/c1-10(3-4-10)6-9(11)8-2-5-12-7-8/h7H,2-6H2,1H3
InChIKeyMMLKHJCYMYDGJR-UHFFFAOYSA-N
XLogP2.05
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydrofuran-4-yl)-2-(1-methylcyclopropyl)ethanone?
The IUPAC name of 1-(2,3-dihydrofuran-4-yl)-2-(1-methylcyclopropyl)ethanone (CID 130917920) is 1-(2,3-dihydrofuran-4-yl)-2-(1-methylcyclopropyl)ethanone.
What is the SMILES notation for 1-(2,3-dihydrofuran-4-yl)-2-(1-methylcyclopropyl)ethanone?
The canonical SMILES for 1-(2,3-dihydrofuran-4-yl)-2-(1-methylcyclopropyl)ethanone is CC1(CC(=O)C2=COCC2)CC1.
What is the InChIKey of 1-(2,3-dihydrofuran-4-yl)-2-(1-methylcyclopropyl)ethanone?
The InChIKey is MMLKHJCYMYDGJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O2/c1-10(3-4-10)6-9(11)8-2-5-12-7-8/h7H,2-6H2,1H3.
What are the key properties of 1-(2,3-dihydrofuran-4-yl)-2-(1-methylcyclopropyl)ethanone?
1-(2,3-dihydrofuran-4-yl)-2-(1-methylcyclopropyl)ethanone has a molecular weight of 166.22 g/mol, XLogP of 2.05, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydrofuran-4-yl)-2-(1-methylcyclopropyl)ethanone is sourced from PubChem (CID 130917920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).