1-[1-(2,2-difluoroethyl)cyclopropyl]ethanone

C7H10F2O — CID 106796985

IUPAC1-[1-(2,2-difluoroethyl)cyclopropyl]ethanone
SMILESCC(=O)C1(CC(F)F)CC1
InChIInChI=1S/C7H10F2O/c1-5(10)7(2-3-7)4-6(8)9/h6H,2-4H2,1H3
InChIKeyHDHWHVNASVSGRS-UHFFFAOYSA-N
MW148.15 g/mol
LogP2.01
Rot. Bonds3

About 1-[1-(2,2-difluoroethyl)cyclopropyl]ethanone

1-[1-(2,2-difluoroethyl)cyclopropyl]ethanone (PubChem CID 106796985) has the molecular formula C7H10F2O and a molecular weight of 148.15 g/mol. Its IUPAC name is 1-[1-(2,2-difluoroethyl)cyclopropyl]ethanone.

Molecular Properties

Compound Name1-[1-(2,2-difluoroethyl)cyclopropyl]ethanone
PubChem CID106796985
Molecular FormulaC7H10F2O
Molecular Weight148.15 g/mol
Exact Mass148.07
IUPAC Name1-[1-(2,2-difluoroethyl)cyclopropyl]ethanone
SMILESCC(=O)C1(CC(F)F)CC1
InChIInChI=1S/C7H10F2O/c1-5(10)7(2-3-7)4-6(8)9/h6H,2-4H2,1H3
InChIKeyHDHWHVNASVSGRS-UHFFFAOYSA-N
XLogP2.01
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.15
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-[1-(2,2-difluoroethyl)cyclopropyl]ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2,2-difluoroethyl)cyclopentane-1-carboxylic acid
CID 79425246
3-(2,2-difluoroethyl)-1-methylazetidine-3-carboxylic acid
CID 115015302
1-(2,2-difluoroethyl)-4-methylcyclohexane-1-carboxylic acid
CID 79425430
4-tert-butyl-1-(2,2-difluoroethyl)cyclohexane-1-carboxylic acid
CID 79425033
1-(2,2-difluoroethyl)cyclohex-3-ene-1-carboxylic acid
CID 126987637
1-[1-(4,4,4-trifluorobutyl)cyclopropyl]ethanone
CID 106797132
1-(1-octylcyclopropyl)ethanone
CID 22042371
N-[3-(2,2-difluoroethyl)azetidin-3-yl]acetamide
CID 130691680
1-[3-(2-methylpropyl)pyrrolidin-3-yl]ethanone
CID 176937427
1-(methylsulfanylmethyl)cyclopropane-1-carboxylic acid;1-[1-(methylsulfanylmethyl)cyclopropyl]ethanone
CID 157066504
N-[(1-acetylcyclopropyl)methyl]-3-oxobutanamide
CID 170262163
1-[4-(aminomethyl)-1-methylpiperidin-4-yl]ethanone
CID 178047336

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2,2-difluoroethyl)cyclopropyl]ethanone?
The IUPAC name of 1-[1-(2,2-difluoroethyl)cyclopropyl]ethanone (CID 106796985) is 1-[1-(2,2-difluoroethyl)cyclopropyl]ethanone.
What is the SMILES notation for 1-[1-(2,2-difluoroethyl)cyclopropyl]ethanone?
The canonical SMILES for 1-[1-(2,2-difluoroethyl)cyclopropyl]ethanone is CC(=O)C1(CC(F)F)CC1.
What is the InChIKey of 1-[1-(2,2-difluoroethyl)cyclopropyl]ethanone?
The InChIKey is HDHWHVNASVSGRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10F2O/c1-5(10)7(2-3-7)4-6(8)9/h6H,2-4H2,1H3.
What are the key properties of 1-[1-(2,2-difluoroethyl)cyclopropyl]ethanone?
1-[1-(2,2-difluoroethyl)cyclopropyl]ethanone has a molecular weight of 148.15 g/mol, XLogP of 2.01, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2,2-difluoroethyl)cyclopropyl]ethanone is sourced from PubChem (CID 106796985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).