1-cyclopropyl-3-(furan-3-yl)propan-1-one

C10H12O2 — CID 64504771

IUPAC1-cyclopropyl-3-(furan-3-yl)propan-1-one
SMILESO=C(CCc1ccoc1)C1CC1
InChIInChI=1S/C10H12O2/c11-10(9-2-3-9)4-1-8-5-6-12-7-8/h5-7,9H,1-4H2
InChIKeyBMAKOFWNQRFRRT-UHFFFAOYSA-N
MW164.20 g/mol
LogP2.19
Rot. Bonds4

About 1-cyclopropyl-3-(furan-3-yl)propan-1-one

1-cyclopropyl-3-(furan-3-yl)propan-1-one (PubChem CID 64504771) has the molecular formula C10H12O2 and a molecular weight of 164.20 g/mol. Its IUPAC name is 1-cyclopropyl-3-(furan-3-yl)propan-1-one.

Molecular Properties

Compound Name1-cyclopropyl-3-(furan-3-yl)propan-1-one
PubChem CID64504771
Molecular FormulaC10H12O2
Molecular Weight164.20 g/mol
Exact Mass164.08
IUPAC Name1-cyclopropyl-3-(furan-3-yl)propan-1-one
SMILESO=C(CCc1ccoc1)C1CC1
InChIInChI=1S/C10H12O2/c11-10(9-2-3-9)4-1-8-5-6-12-7-8/h5-7,9H,1-4H2
InChIKeyBMAKOFWNQRFRRT-UHFFFAOYSA-N
XLogP2.19
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.20
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopropyl-3-phenylpropan-1-one
CID 24725607
3-(4-aminophenyl)-1-cyclopropylpropan-1-one
CID 115605902
2-(furan-3-yl)-1-(3-methylcyclopentyl)ethanone
CID 83171833
1-cyclopropyl-3-(4-methylphenyl)propan-1-one;ethane
CID 143103497
1-cyclopropyl-3-(3,5-dimethylphenyl)propan-1-one
CID 24726531
2-[(2S)-1-[3-(furan-3-yl)propanoyl]pyrrolidin-2-yl]acetic acid
CID 129468857
1-cyclohexyl-2-[furan-3-ylmethyl(methyl)amino]ethanone
CID 104750523
1-(6-bicyclo[3.1.0]hexanyl)-2-(furan-3-yl)ethanone
CID 115795935
N-cyclobutyl-N-[1-[3-(furan-3-yl)propanoyl]azepan-4-yl]acetamide
CID 128966915
3-cyclopropyl-1-(furan-3-yl)butan-2-one
CID 115795878
1-[2-(furan-3-yl)ethyl]-5-oxopyrrolidine-3-carboxylic acid
CID 168691406
1-(3,4-dimethylcyclohexyl)-3-phenylpropan-1-one
CID 64739627

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(furan-3-yl)propan-1-one?
The IUPAC name of 1-cyclopropyl-3-(furan-3-yl)propan-1-one (CID 64504771) is 1-cyclopropyl-3-(furan-3-yl)propan-1-one.
What is the SMILES notation for 1-cyclopropyl-3-(furan-3-yl)propan-1-one?
The canonical SMILES for 1-cyclopropyl-3-(furan-3-yl)propan-1-one is O=C(CCc1ccoc1)C1CC1.
What is the InChIKey of 1-cyclopropyl-3-(furan-3-yl)propan-1-one?
The InChIKey is BMAKOFWNQRFRRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O2/c11-10(9-2-3-9)4-1-8-5-6-12-7-8/h5-7,9H,1-4H2.
What are the key properties of 1-cyclopropyl-3-(furan-3-yl)propan-1-one?
1-cyclopropyl-3-(furan-3-yl)propan-1-one has a molecular weight of 164.20 g/mol, XLogP of 2.19, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(furan-3-yl)propan-1-one is sourced from PubChem (CID 64504771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).