furan-2-yl-[3-(2,2,2-trifluoroethoxy)azetidin-1-yl]methanone

C10H10F3NO3 — CID 119101589

IUPACfuran-2-yl-[3-(2,2,2-trifluoroethoxy)azetidin-1-yl]methanone
SMILESO=C(c1ccco1)N1CC(OCC(F)(F)F)C1
InChIInChI=1S/C10H10F3NO3/c11-10(12,13)6-17-7-4-14(5-7)9(15)8-2-1-3-16-8/h1-3,7H,4-6H2
InChIKeyPLSDFQWCPDYSCU-UHFFFAOYSA-N
MW249.19 g/mol
LogP1.68
Rot. Bonds3

About furan-2-yl-[3-(2,2,2-trifluoroethoxy)azetidin-1-yl]methanone

furan-2-yl-[3-(2,2,2-trifluoroethoxy)azetidin-1-yl]methanone (PubChem CID 119101589) has the molecular formula C10H10F3NO3 and a molecular weight of 249.19 g/mol. Its IUPAC name is furan-2-yl-[3-(2,2,2-trifluoroethoxy)azetidin-1-yl]methanone.

Molecular Properties

Compound Namefuran-2-yl-[3-(2,2,2-trifluoroethoxy)azetidin-1-yl]methanone
PubChem CID119101589
Molecular FormulaC10H10F3NO3
Molecular Weight249.19 g/mol
Exact Mass249.06
IUPAC Namefuran-2-yl-[3-(2,2,2-trifluoroethoxy)azetidin-1-yl]methanone
SMILESO=C(c1ccco1)N1CC(OCC(F)(F)F)C1
InChIInChI=1S/C10H10F3NO3/c11-10(12,13)6-17-7-4-14(5-7)9(15)8-2-1-3-16-8/h1-3,7H,4-6H2
InChIKeyPLSDFQWCPDYSCU-UHFFFAOYSA-N
XLogP1.68
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.19
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

furan-2-yl-(2-methyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl)methanone
CID 121185227
2-[1-(furan-2-carbonyl)azetidin-3-yl]acetic acid
CID 64605217
(3,5-dimethylpiperidin-1-yl)-(furan-2-yl)methanone
CID 3554553
[(3R,5R)-3,5-dimethylpiperidin-1-yl]-(furan-2-yl)methanone
CID 669413
[3-[(4-fluorophenyl)methoxy]piperidin-1-yl]-(furan-2-yl)methanone
CID 42844110
furan-2-yl-[(3S)-3-[[4-(trifluoromethyl)-2-pyridinyl]oxy]pyrrolidin-1-yl]methanone
CID 100737713
furan-2-yl-[3-(3-phenylpropoxy)pyrrolidin-1-yl]methanone
CID 71860926
4-(furan-2-carbonyl)-N-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methyl]piperazine-1-carboxamide
CID 41199927
[1-(furan-2-carbonyl)azetidin-3-yl] N-(3-fluorophenyl)carbamate
CID 99823138
4-(furan-2-carbonyl)-N'-methyl-N-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methyl]piperazine-1-carboximidamide;hydroiodide
CID 111167314
3-[1-(furan-2-carbonyl)piperidin-4-yl]oxypropanoic acid
CID 63875477
furan-2-yl-(3-phenoxypiperidin-1-yl)methanone
CID 110605371

Frequently Asked Questions

What is the IUPAC name of furan-2-yl-[3-(2,2,2-trifluoroethoxy)azetidin-1-yl]methanone?
The IUPAC name of furan-2-yl-[3-(2,2,2-trifluoroethoxy)azetidin-1-yl]methanone (CID 119101589) is furan-2-yl-[3-(2,2,2-trifluoroethoxy)azetidin-1-yl]methanone.
What is the SMILES notation for furan-2-yl-[3-(2,2,2-trifluoroethoxy)azetidin-1-yl]methanone?
The canonical SMILES for furan-2-yl-[3-(2,2,2-trifluoroethoxy)azetidin-1-yl]methanone is O=C(c1ccco1)N1CC(OCC(F)(F)F)C1.
What is the InChIKey of furan-2-yl-[3-(2,2,2-trifluoroethoxy)azetidin-1-yl]methanone?
The InChIKey is PLSDFQWCPDYSCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3NO3/c11-10(12,13)6-17-7-4-14(5-7)9(15)8-2-1-3-16-8/h1-3,7H,4-6H2.
What are the key properties of furan-2-yl-[3-(2,2,2-trifluoroethoxy)azetidin-1-yl]methanone?
furan-2-yl-[3-(2,2,2-trifluoroethoxy)azetidin-1-yl]methanone has a molecular weight of 249.19 g/mol, XLogP of 1.68, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-[3-(2,2,2-trifluoroethoxy)azetidin-1-yl]methanone is sourced from PubChem (CID 119101589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).