2,3-dihydro-1H-inden-2-yl-(5-fluoro-1-benzofuran-2-yl)methanone

C18H13FO2 — CID 114725484

IUPAC2,3-dihydro-1H-inden-2-yl-(5-fluoro-1-benzofuran-2-yl)methanone
SMILESO=C(c1cc2cc(F)ccc2o1)C1Cc2ccccc2C1
InChIInChI=1S/C18H13FO2/c19-15-5-6-16-13(9-15)10-17(21-16)18(20)14-7-11-3-1-2-4-12(11)8-14/h1-6,9-10,14H,7-8H2
InChIKeyOJRMICORYJOMHZ-UHFFFAOYSA-N
MW280.30 g/mol
LogP4.17
Rot. Bonds2

About 2,3-dihydro-1H-inden-2-yl-(5-fluoro-1-benzofuran-2-yl)methanone

2,3-dihydro-1H-inden-2-yl-(5-fluoro-1-benzofuran-2-yl)methanone (PubChem CID 114725484) has the molecular formula C18H13FO2 and a molecular weight of 280.30 g/mol. Its IUPAC name is 2,3-dihydro-1H-inden-2-yl-(5-fluoro-1-benzofuran-2-yl)methanone.

Molecular Properties

Compound Name2,3-dihydro-1H-inden-2-yl-(5-fluoro-1-benzofuran-2-yl)methanone
PubChem CID114725484
Molecular FormulaC18H13FO2
Molecular Weight280.30 g/mol
Exact Mass280.09
IUPAC Name2,3-dihydro-1H-inden-2-yl-(5-fluoro-1-benzofuran-2-yl)methanone
SMILESO=C(c1cc2cc(F)ccc2o1)C1Cc2ccccc2C1
InChIInChI=1S/C18H13FO2/c19-15-5-6-16-13(9-15)10-17(21-16)18(20)14-7-11-3-1-2-4-12(11)8-14/h1-6,9-10,14H,7-8H2
InChIKeyOJRMICORYJOMHZ-UHFFFAOYSA-N
XLogP4.17
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.30
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2,2-dimethylcyclopropyl)-(5-fluoro-1-benzofuran-2-yl)methanone
CID 107004043
(5-fluoro-1-benzofuran-2-yl)-(2-methylphenyl)methanone
CID 113338112
2,2-difluoro-1-(5-fluoro-1-benzofuran-2-yl)ethanone
CID 114726024
(7-chloro-1-benzofuran-2-yl)-(2,3-dihydro-1H-inden-2-yl)methanone
CID 114725485
(5-fluoro-1-benzofuran-2-yl)-(1-phenylcyclopropyl)methanone
CID 114725249
1-(5-fluoro-1-benzofuran-2-yl)propan-1-one
CID 65426130
2,3-dihydro-1H-inden-2-yl-(4-fluoro-2-methylphenyl)methanone
CID 65406838
(2-bromo-5-fluorophenyl)-(2,3-dihydro-1H-inden-2-yl)methanone
CID 106893007
(2,3-difluorophenyl)-(5-fluoro-1-benzofuran-2-yl)methanone
CID 115808883
(5-fluoro-1-benzofuran-2-yl)-(3-fluoro-5-methylphenyl)methanone
CID 114725891
(3-bromophenyl)-(5-fluoro-1-benzofuran-2-yl)methanone
CID 114724999
2-amino-1-(5-fluoro-1-benzofuran-2-yl)-3-methylbutan-1-one
CID 114736167

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-inden-2-yl-(5-fluoro-1-benzofuran-2-yl)methanone?
The IUPAC name of 2,3-dihydro-1H-inden-2-yl-(5-fluoro-1-benzofuran-2-yl)methanone (CID 114725484) is 2,3-dihydro-1H-inden-2-yl-(5-fluoro-1-benzofuran-2-yl)methanone.
What is the SMILES notation for 2,3-dihydro-1H-inden-2-yl-(5-fluoro-1-benzofuran-2-yl)methanone?
The canonical SMILES for 2,3-dihydro-1H-inden-2-yl-(5-fluoro-1-benzofuran-2-yl)methanone is O=C(c1cc2cc(F)ccc2o1)C1Cc2ccccc2C1.
What is the InChIKey of 2,3-dihydro-1H-inden-2-yl-(5-fluoro-1-benzofuran-2-yl)methanone?
The InChIKey is OJRMICORYJOMHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13FO2/c19-15-5-6-16-13(9-15)10-17(21-16)18(20)14-7-11-3-1-2-4-12(11)8-14/h1-6,9-10,14H,7-8H2.
What are the key properties of 2,3-dihydro-1H-inden-2-yl-(5-fluoro-1-benzofuran-2-yl)methanone?
2,3-dihydro-1H-inden-2-yl-(5-fluoro-1-benzofuran-2-yl)methanone has a molecular weight of 280.30 g/mol, XLogP of 4.17, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-inden-2-yl-(5-fluoro-1-benzofuran-2-yl)methanone is sourced from PubChem (CID 114725484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).