[3-(4-fluorophenyl)sulfonylazetidin-1-yl]-(furan-3-yl)methanone

C14H12FNO4S — CID 71809262

IUPAC[3-(4-fluorophenyl)sulfonylazetidin-1-yl]-(furan-3-yl)methanone
SMILESO=C(c1ccoc1)N1CC(S(=O)(=O)c2ccc(F)cc2)C1
InChIInChI=1S/C14H12FNO4S/c15-11-1-3-12(4-2-11)21(18,19)13-7-16(8-13)14(17)10-5-6-20-9-10/h1-6,9,13H,7-8H2
InChIKeyFPNGFIWMWBEZBR-UHFFFAOYSA-N
MW309.32 g/mol
LogP1.72
Rot. Bonds3

About [3-(4-fluorophenyl)sulfonylazetidin-1-yl]-(furan-3-yl)methanone

[3-(4-fluorophenyl)sulfonylazetidin-1-yl]-(furan-3-yl)methanone (PubChem CID 71809262) has the molecular formula C14H12FNO4S and a molecular weight of 309.32 g/mol. Its IUPAC name is [3-(4-fluorophenyl)sulfonylazetidin-1-yl]-(furan-3-yl)methanone.

Molecular Properties

Compound Name[3-(4-fluorophenyl)sulfonylazetidin-1-yl]-(furan-3-yl)methanone
PubChem CID71809262
Molecular FormulaC14H12FNO4S
Molecular Weight309.32 g/mol
Exact Mass309.05
IUPAC Name[3-(4-fluorophenyl)sulfonylazetidin-1-yl]-(furan-3-yl)methanone
SMILESO=C(c1ccoc1)N1CC(S(=O)(=O)c2ccc(F)cc2)C1
InChIInChI=1S/C14H12FNO4S/c15-11-1-3-12(4-2-11)21(18,19)13-7-16(8-13)14(17)10-5-6-20-9-10/h1-6,9,13H,7-8H2
InChIKeyFPNGFIWMWBEZBR-UHFFFAOYSA-N
XLogP1.72
TPSA67.59 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.32
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze [3-(4-fluorophenyl)sulfonylazetidin-1-yl]-(furan-3-yl)methanone 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-[3-(4-fluorophenyl)sulfonylazetidin-1-yl]ethanone
CID 71809175
2,1,3-benzothiadiazol-5-yl-[3-(4-fluorophenyl)sulfonylazetidin-1-yl]methanone
CID 71809204
(3,4-diethoxyphenyl)-[3-(4-fluorophenyl)sulfonylazetidin-1-yl]methanone
CID 90593103
(4-fluorophenyl)-[4-(4-fluorophenyl)sulfonylpiperidin-1-yl]methanone
CID 90589559
2-(4-fluorophenyl)-1-[3-(4-fluorophenyl)sulfonylazetidin-1-yl]ethanone
CID 90592908
4-fluoro-N-[[1-(furan-3-carbonyl)piperidin-4-yl]methyl]benzenesulfonamide
CID 90521856
[3-(chloromethyl)azetidin-1-yl]-(furan-3-yl)methanone
CID 130531402
2-ethyl-1-[3-(4-fluorophenyl)sulfonylazetidin-1-yl]butan-1-one
CID 90593118
2,2,3,3,4,4,4-heptafluoro-1-[3-(4-fluorophenyl)sulfonylazetidin-1-yl]butan-1-one
CID 90593088
[(3R)-3-(4-fluorophenyl)azepan-1-yl]-(furan-3-yl)methanone
CID 99883345
(3R)-1-(furan-3-carbonyl)piperidine-3-sulfonamide
CID 129366066
(3S)-1-(furan-3-carbonyl)piperidine-3-sulfonamide
CID 129366065

Frequently Asked Questions

What is the IUPAC name of [3-(4-fluorophenyl)sulfonylazetidin-1-yl]-(furan-3-yl)methanone?
The IUPAC name of [3-(4-fluorophenyl)sulfonylazetidin-1-yl]-(furan-3-yl)methanone (CID 71809262) is [3-(4-fluorophenyl)sulfonylazetidin-1-yl]-(furan-3-yl)methanone.
What is the SMILES notation for [3-(4-fluorophenyl)sulfonylazetidin-1-yl]-(furan-3-yl)methanone?
The canonical SMILES for [3-(4-fluorophenyl)sulfonylazetidin-1-yl]-(furan-3-yl)methanone is O=C(c1ccoc1)N1CC(S(=O)(=O)c2ccc(F)cc2)C1.
What is the InChIKey of [3-(4-fluorophenyl)sulfonylazetidin-1-yl]-(furan-3-yl)methanone?
The InChIKey is FPNGFIWMWBEZBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FNO4S/c15-11-1-3-12(4-2-11)21(18,19)13-7-16(8-13)14(17)10-5-6-20-9-10/h1-6,9,13H,7-8H2.
What are the key properties of [3-(4-fluorophenyl)sulfonylazetidin-1-yl]-(furan-3-yl)methanone?
[3-(4-fluorophenyl)sulfonylazetidin-1-yl]-(furan-3-yl)methanone has a molecular weight of 309.32 g/mol, XLogP of 1.72, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-fluorophenyl)sulfonylazetidin-1-yl]-(furan-3-yl)methanone is sourced from PubChem (CID 71809262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).