1-(4-fluoro-5,6-dihydro-4H-cyclopenta[d][1,2]oxazol-3-yl)ethanone

C8H8FNO2 — CID 105434014

IUPAC1-(4-fluoro-5,6-dihydro-4H-cyclopenta[d][1,2]oxazol-3-yl)ethanone
SMILESCC(=O)c1noc2c1C(F)CC2
InChIInChI=1S/C8H8FNO2/c1-4(11)8-7-5(9)2-3-6(7)12-10-8/h5H,2-3H2,1H3
InChIKeyMBPFTZASRNMOLS-UHFFFAOYSA-N
MW169.15 g/mol
LogP1.83
Rot. Bonds1

About 1-(4-fluoro-5,6-dihydro-4H-cyclopenta[d][1,2]oxazol-3-yl)ethanone

1-(4-fluoro-5,6-dihydro-4H-cyclopenta[d][1,2]oxazol-3-yl)ethanone (PubChem CID 105434014) has the molecular formula C8H8FNO2 and a molecular weight of 169.15 g/mol. Its IUPAC name is 1-(4-fluoro-5,6-dihydro-4H-cyclopenta[d][1,2]oxazol-3-yl)ethanone.

Molecular Properties

Compound Name1-(4-fluoro-5,6-dihydro-4H-cyclopenta[d][1,2]oxazol-3-yl)ethanone
PubChem CID105434014
Molecular FormulaC8H8FNO2
Molecular Weight169.15 g/mol
Exact Mass169.05
IUPAC Name1-(4-fluoro-5,6-dihydro-4H-cyclopenta[d][1,2]oxazol-3-yl)ethanone
SMILESCC(=O)c1noc2c1C(F)CC2
InChIInChI=1S/C8H8FNO2/c1-4(11)8-7-5(9)2-3-6(7)12-10-8/h5H,2-3H2,1H3
InChIKeyMBPFTZASRNMOLS-UHFFFAOYSA-N
XLogP1.83
TPSA43.10 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.15
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(4-fluoro-5,6-dihydro-4H-cyclopenta[d][1,2]oxazol-3-yl)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-(4,5-Dimethylisoxazol-3-yl)ethanone
CID 71434463
4H,5H,6H-cyclopenta(d)(1,2)oxazole-3-carbaldehyde
CID 28808650
sodium 4H,5H,6H-cyclopenta(d)(1,2)oxazole-3-carboxylate
CID 145913206
ethyl 5,6-dihydro-4H-cyclopenta[d]isoxazole-3-carboxylate
CID 23006225
5-Isobutyl-4-(trifluoromethyl)isoxazole-3-carbonyl fluoride
CID 86656394
6-fluoro-3-methyl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole
CID 89095932
3-(Trifluoromethyl)-4,5,6,7,8,9-hexahydrocycloocta[c][1,2]oxazole
CID 153530568
4-(1,1-Difluorobutyl)-3,5-dimethyl-1,2-oxazole
CID 170592640
3,5-Dimethyl-4-pentylisoxazole
CID 45099334
14-Methyl-12-oxa-13-azabicyclo[9.2.1]tetradeca-1(13),11(14)-diene
CID 12637115
4-Ethyl-3,5-dipropylisoxazole
CID 44720140
5,6-Dihydro-4H-cyclopenta[d]isoxazole-3-carboxylic acid
CID 23006221

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluoro-5,6-dihydro-4H-cyclopenta[d][1,2]oxazol-3-yl)ethanone?
The IUPAC name of 1-(4-fluoro-5,6-dihydro-4H-cyclopenta[d][1,2]oxazol-3-yl)ethanone (CID 105434014) is 1-(4-fluoro-5,6-dihydro-4H-cyclopenta[d][1,2]oxazol-3-yl)ethanone.
What is the SMILES notation for 1-(4-fluoro-5,6-dihydro-4H-cyclopenta[d][1,2]oxazol-3-yl)ethanone?
The canonical SMILES for 1-(4-fluoro-5,6-dihydro-4H-cyclopenta[d][1,2]oxazol-3-yl)ethanone is CC(=O)c1noc2c1C(F)CC2.
What is the InChIKey of 1-(4-fluoro-5,6-dihydro-4H-cyclopenta[d][1,2]oxazol-3-yl)ethanone?
The InChIKey is MBPFTZASRNMOLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8FNO2/c1-4(11)8-7-5(9)2-3-6(7)12-10-8/h5H,2-3H2,1H3.
What are the key properties of 1-(4-fluoro-5,6-dihydro-4H-cyclopenta[d][1,2]oxazol-3-yl)ethanone?
1-(4-fluoro-5,6-dihydro-4H-cyclopenta[d][1,2]oxazol-3-yl)ethanone has a molecular weight of 169.15 g/mol, XLogP of 1.83, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluoro-5,6-dihydro-4H-cyclopenta[d][1,2]oxazol-3-yl)ethanone is sourced from PubChem (CID 105434014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).