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

C15H14O2 — CID 106893079

IUPAC2,3-dihydro-1H-inden-2-yl-(5-methylfuran-3-yl)methanone
SMILESCc1cc(C(=O)C2Cc3ccccc3C2)co1
InChIInChI=1S/C15H14O2/c1-10-6-14(9-17-10)15(16)13-7-11-4-2-3-5-12(11)8-13/h2-6,9,13H,7-8H2,1H3
InChIKeyGQYWEDPODYTRMM-UHFFFAOYSA-N
MW226.28 g/mol
LogP3.19
Rot. Bonds2

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

2,3-dihydro-1H-inden-2-yl-(5-methylfuran-3-yl)methanone (PubChem CID 106893079) has the molecular formula C15H14O2 and a molecular weight of 226.28 g/mol. Its IUPAC name is 2,3-dihydro-1H-inden-2-yl-(5-methylfuran-3-yl)methanone.

Molecular Properties

Compound Name2,3-dihydro-1H-inden-2-yl-(5-methylfuran-3-yl)methanone
PubChem CID106893079
Molecular FormulaC15H14O2
Molecular Weight226.28 g/mol
Exact Mass226.10
IUPAC Name2,3-dihydro-1H-inden-2-yl-(5-methylfuran-3-yl)methanone
SMILESCc1cc(C(=O)C2Cc3ccccc3C2)co1
InChIInChI=1S/C15H14O2/c1-10-6-14(9-17-10)15(16)13-7-11-4-2-3-5-12(11)8-13/h2-6,9,13H,7-8H2,1H3
InChIKeyGQYWEDPODYTRMM-UHFFFAOYSA-N
XLogP3.19
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-inden-2-yl-(5-methylfuran-3-yl)methanone?
The IUPAC name of 2,3-dihydro-1H-inden-2-yl-(5-methylfuran-3-yl)methanone (CID 106893079) is 2,3-dihydro-1H-inden-2-yl-(5-methylfuran-3-yl)methanone.
What is the SMILES notation for 2,3-dihydro-1H-inden-2-yl-(5-methylfuran-3-yl)methanone?
The canonical SMILES for 2,3-dihydro-1H-inden-2-yl-(5-methylfuran-3-yl)methanone is Cc1cc(C(=O)C2Cc3ccccc3C2)co1.
What is the InChIKey of 2,3-dihydro-1H-inden-2-yl-(5-methylfuran-3-yl)methanone?
The InChIKey is GQYWEDPODYTRMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O2/c1-10-6-14(9-17-10)15(16)13-7-11-4-2-3-5-12(11)8-13/h2-6,9,13H,7-8H2,1H3.
What are the key properties of 2,3-dihydro-1H-inden-2-yl-(5-methylfuran-3-yl)methanone?
2,3-dihydro-1H-inden-2-yl-(5-methylfuran-3-yl)methanone has a molecular weight of 226.28 g/mol, XLogP of 3.19, 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-methylfuran-3-yl)methanone is sourced from PubChem (CID 106893079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).