2-(2,3-dihydro-1-benzofuran-5-yl)-3,4-dihydro-2H-chromene

C17H16O2 — CID 173225746

IUPAC2-(2,3-dihydro-1-benzofuran-5-yl)-3,4-dihydro-2H-chromene
SMILESc1ccc2c(c1)CCC(c1ccc3c(c1)CCO3)O2
InChIInChI=1S/C17H16O2/c1-2-4-16-12(3-1)5-8-17(19-16)13-6-7-15-14(11-13)9-10-18-15/h1-4,6-7,11,17H,5,8-10H2
InChIKeyMXQGYCGZERSQIK-UHFFFAOYSA-N
MW252.31 g/mol
LogP3.69
Rot. Bonds1

About 2-(2,3-dihydro-1-benzofuran-5-yl)-3,4-dihydro-2H-chromene

2-(2,3-dihydro-1-benzofuran-5-yl)-3,4-dihydro-2H-chromene (PubChem CID 173225746) has the molecular formula C17H16O2 and a molecular weight of 252.31 g/mol. Its IUPAC name is 2-(2,3-dihydro-1-benzofuran-5-yl)-3,4-dihydro-2H-chromene.

Molecular Properties

Compound Name2-(2,3-dihydro-1-benzofuran-5-yl)-3,4-dihydro-2H-chromene
PubChem CID173225746
Molecular FormulaC17H16O2
Molecular Weight252.31 g/mol
Exact Mass252.12
IUPAC Name2-(2,3-dihydro-1-benzofuran-5-yl)-3,4-dihydro-2H-chromene
SMILESc1ccc2c(c1)CCC(c1ccc3c(c1)CCO3)O2
InChIInChI=1S/C17H16O2/c1-2-4-16-12(3-1)5-8-17(19-16)13-6-7-15-14(11-13)9-10-18-15/h1-4,6-7,11,17H,5,8-10H2
InChIKeyMXQGYCGZERSQIK-UHFFFAOYSA-N
XLogP3.69
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,4-dihydro-2H-chromen-6-yl)-3,4-dihydro-2H-chromene
CID 173011896
2-phenyl-3,4-dihydro-2H-chromene
CID 157336431
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-(3,4-dihydro-2H-chromen-2-yl)-2,3-dihydro-1,4-benzoxathiine
CID 130382341
2,3-dihydro-1-benzofuran;ethane
CID 54441538
calcium;carbonic acid;hydride;2-phenyl-3,4-dihydro-2H-chromene
CID 175471981
5-cyclohexyl-2,3-dihydro-1-benzofuran
CID 150562442
CID 163793293
CID 163793293
6-chloro-2-phenyl-3,4-dihydro-2H-chromene
CID 13250352
4-(3,4-dihydro-2H-chromen-2-yl)-1-oxidopyridin-1-ium
CID 57215409
bromomethane;2,3-dihydro-1-benzofuran
CID 69259048
2-phenyl-3,4-dihydro-2H-chromen-6-ol;zinc
CID 160688399
(2S)-2-(2,3-dihydro-1-benzofuran-5-yl)azetidine;hydrochloride
CID 171196730

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1-benzofuran-5-yl)-3,4-dihydro-2H-chromene?
The IUPAC name of 2-(2,3-dihydro-1-benzofuran-5-yl)-3,4-dihydro-2H-chromene (CID 173225746) is 2-(2,3-dihydro-1-benzofuran-5-yl)-3,4-dihydro-2H-chromene.
What is the SMILES notation for 2-(2,3-dihydro-1-benzofuran-5-yl)-3,4-dihydro-2H-chromene?
The canonical SMILES for 2-(2,3-dihydro-1-benzofuran-5-yl)-3,4-dihydro-2H-chromene is c1ccc2c(c1)CCC(c1ccc3c(c1)CCO3)O2.
What is the InChIKey of 2-(2,3-dihydro-1-benzofuran-5-yl)-3,4-dihydro-2H-chromene?
The InChIKey is MXQGYCGZERSQIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16O2/c1-2-4-16-12(3-1)5-8-17(19-16)13-6-7-15-14(11-13)9-10-18-15/h1-4,6-7,11,17H,5,8-10H2.
What are the key properties of 2-(2,3-dihydro-1-benzofuran-5-yl)-3,4-dihydro-2H-chromene?
2-(2,3-dihydro-1-benzofuran-5-yl)-3,4-dihydro-2H-chromene has a molecular weight of 252.31 g/mol, XLogP of 3.69, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1-benzofuran-5-yl)-3,4-dihydro-2H-chromene is sourced from PubChem (CID 173225746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).