2-(4,6-difluoro-2,3-dihydro-1-benzofuran-7-yl)morpholine

C12H13F2NO2 — CID 117354578

IUPAC2-(4,6-difluoro-2,3-dihydro-1-benzofuran-7-yl)morpholine
SMILESFc1cc(F)c(C2CNCCO2)c2c1CCO2
InChIInChI=1S/C12H13F2NO2/c13-8-5-9(14)11(10-6-15-2-4-16-10)12-7(8)1-3-17-12/h5,10,15H,1-4,6H2
InChIKeyWZLRRELCHGXCEG-UHFFFAOYSA-N
MW241.24 g/mol
LogP1.56
Rot. Bonds1

About 2-(4,6-difluoro-2,3-dihydro-1-benzofuran-7-yl)morpholine

2-(4,6-difluoro-2,3-dihydro-1-benzofuran-7-yl)morpholine (PubChem CID 117354578) has the molecular formula C12H13F2NO2 and a molecular weight of 241.24 g/mol. Its IUPAC name is 2-(4,6-difluoro-2,3-dihydro-1-benzofuran-7-yl)morpholine.

Molecular Properties

Compound Name2-(4,6-difluoro-2,3-dihydro-1-benzofuran-7-yl)morpholine
PubChem CID117354578
Molecular FormulaC12H13F2NO2
Molecular Weight241.24 g/mol
Exact Mass241.09
IUPAC Name2-(4,6-difluoro-2,3-dihydro-1-benzofuran-7-yl)morpholine
SMILESFc1cc(F)c(C2CNCCO2)c2c1CCO2
InChIInChI=1S/C12H13F2NO2/c13-8-5-9(14)11(10-6-15-2-4-16-10)12-7(8)1-3-17-12/h5,10,15H,1-4,6H2
InChIKeyWZLRRELCHGXCEG-UHFFFAOYSA-N
XLogP1.56
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.24
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4,6-difluoro-2,3-dihydro-1-benzofuran-7-yl)pyrrolidine
CID 117322941
3-(5,7-difluoro-3,4-dihydro-2H-chromen-8-yl)piperidine
CID 117385756
2-(2-chloro-3,6-difluorophenyl)morpholine
CID 117339537
2-(4-bromo-2,3,5,6-tetrafluorophenyl)morpholine
CID 115111889
6-bromo-3,4-difluoro-2-morpholin-2-ylphenol
CID 117474310
3,4-difluoro-2-morpholin-2-ylphenol
CID 117306324
2-(3-fluoro-4-methylphenyl)morpholine
CID 65122034
(2R)-2-(2,4-difluorophenyl)morpholine
CID 93302359
4-bromo-6-fluoro-2-methoxy-3-morpholin-2-ylphenol
CID 117491098
2-(7-chloro-5-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)morpholine
CID 117427284
2,5-difluoro-4-morpholin-2-ylphenol
CID 117306323
2-(2-fluoro-4-methylphenyl)morpholine
CID 83698750

Frequently Asked Questions

What is the IUPAC name of 2-(4,6-difluoro-2,3-dihydro-1-benzofuran-7-yl)morpholine?
The IUPAC name of 2-(4,6-difluoro-2,3-dihydro-1-benzofuran-7-yl)morpholine (CID 117354578) is 2-(4,6-difluoro-2,3-dihydro-1-benzofuran-7-yl)morpholine.
What is the SMILES notation for 2-(4,6-difluoro-2,3-dihydro-1-benzofuran-7-yl)morpholine?
The canonical SMILES for 2-(4,6-difluoro-2,3-dihydro-1-benzofuran-7-yl)morpholine is Fc1cc(F)c(C2CNCCO2)c2c1CCO2.
What is the InChIKey of 2-(4,6-difluoro-2,3-dihydro-1-benzofuran-7-yl)morpholine?
The InChIKey is WZLRRELCHGXCEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13F2NO2/c13-8-5-9(14)11(10-6-15-2-4-16-10)12-7(8)1-3-17-12/h5,10,15H,1-4,6H2.
What are the key properties of 2-(4,6-difluoro-2,3-dihydro-1-benzofuran-7-yl)morpholine?
2-(4,6-difluoro-2,3-dihydro-1-benzofuran-7-yl)morpholine has a molecular weight of 241.24 g/mol, XLogP of 1.56, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,6-difluoro-2,3-dihydro-1-benzofuran-7-yl)morpholine is sourced from PubChem (CID 117354578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).