2,3-dihydro-1H-inden-1-yl-(7-fluoro-1-benzofuran-2-yl)methanol

C18H15FO2 — CID 114726719

IUPAC2,3-dihydro-1H-inden-1-yl-(7-fluoro-1-benzofuran-2-yl)methanol
SMILESOC(c1cc2cccc(F)c2o1)C1CCc2ccccc21
InChIInChI=1S/C18H15FO2/c19-15-7-3-5-12-10-16(21-18(12)15)17(20)14-9-8-11-4-1-2-6-13(11)14/h1-7,10,14,17,20H,8-9H2
InChIKeyIPDSCRCJJTZGDF-UHFFFAOYSA-N
MW282.31 g/mol
LogP4.34
Rot. Bonds2

About 2,3-dihydro-1H-inden-1-yl-(7-fluoro-1-benzofuran-2-yl)methanol

2,3-dihydro-1H-inden-1-yl-(7-fluoro-1-benzofuran-2-yl)methanol (PubChem CID 114726719) has the molecular formula C18H15FO2 and a molecular weight of 282.31 g/mol. Its IUPAC name is 2,3-dihydro-1H-inden-1-yl-(7-fluoro-1-benzofuran-2-yl)methanol.

Molecular Properties

Compound Name2,3-dihydro-1H-inden-1-yl-(7-fluoro-1-benzofuran-2-yl)methanol
PubChem CID114726719
Molecular FormulaC18H15FO2
Molecular Weight282.31 g/mol
Exact Mass282.11
IUPAC Name2,3-dihydro-1H-inden-1-yl-(7-fluoro-1-benzofuran-2-yl)methanol
SMILESOC(c1cc2cccc(F)c2o1)C1CCc2ccccc21
InChIInChI=1S/C18H15FO2/c19-15-7-3-5-12-10-16(21-18(12)15)17(20)14-9-8-11-4-1-2-6-13(11)14/h1-7,10,14,17,20H,8-9H2
InChIKeyIPDSCRCJJTZGDF-UHFFFAOYSA-N
XLogP4.34
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.31
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4,4-difluorocyclohexyl)-(7-fluoro-1-benzofuran-2-yl)methanol
CID 105130101
(2,2-dimethylcyclohexyl)-(7-fluoro-1-benzofuran-2-yl)methanol
CID 107192972
2,3-dihydro-1H-inden-1-yl(naphthalen-1-yl)methanol
CID 65411181
(7-fluoro-1-benzofuran-2-yl)-(3-methylcyclohexyl)methanol
CID 114724076
2-cyclopropyl-1-(7-fluoro-1-benzofuran-2-yl)ethanol
CID 114727065
(7-fluoro-1-benzofuran-2-yl)-(4-methylmorpholin-2-yl)methanol
CID 114726911
(2,3-difluoro-4-methylphenyl)-(2,3-dihydro-1H-inden-1-yl)methanol
CID 107512914
1-benzofuran-2-yl(2,3-dihydro-1H-inden-1-yl)methanamine
CID 114729328
2-(2,4-difluorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)ethanol
CID 65410003
7-fluoro-2-propan-2-yl-1-benzofuran
CID 88991552
1-(7-fluoro-1-benzofuran-2-yl)-3-(oxolan-2-yl)propan-1-ol
CID 115836935
2,3-dihydro-1H-inden-1-yl-(2-methylphenyl)methanol
CID 65410784

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-inden-1-yl-(7-fluoro-1-benzofuran-2-yl)methanol?
The IUPAC name of 2,3-dihydro-1H-inden-1-yl-(7-fluoro-1-benzofuran-2-yl)methanol (CID 114726719) is 2,3-dihydro-1H-inden-1-yl-(7-fluoro-1-benzofuran-2-yl)methanol.
What is the SMILES notation for 2,3-dihydro-1H-inden-1-yl-(7-fluoro-1-benzofuran-2-yl)methanol?
The canonical SMILES for 2,3-dihydro-1H-inden-1-yl-(7-fluoro-1-benzofuran-2-yl)methanol is OC(c1cc2cccc(F)c2o1)C1CCc2ccccc21.
What is the InChIKey of 2,3-dihydro-1H-inden-1-yl-(7-fluoro-1-benzofuran-2-yl)methanol?
The InChIKey is IPDSCRCJJTZGDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FO2/c19-15-7-3-5-12-10-16(21-18(12)15)17(20)14-9-8-11-4-1-2-6-13(11)14/h1-7,10,14,17,20H,8-9H2.
What are the key properties of 2,3-dihydro-1H-inden-1-yl-(7-fluoro-1-benzofuran-2-yl)methanol?
2,3-dihydro-1H-inden-1-yl-(7-fluoro-1-benzofuran-2-yl)methanol has a molecular weight of 282.31 g/mol, XLogP of 4.34, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-inden-1-yl-(7-fluoro-1-benzofuran-2-yl)methanol is sourced from PubChem (CID 114726719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).