dibenzofuran-2-yl-(5-methylfuran-3-yl)methanone

C18H12O3 — CID 114819411

IUPACdibenzofuran-2-yl-(5-methylfuran-3-yl)methanone
SMILESCc1cc(C(=O)c2ccc3oc4ccccc4c3c2)co1
InChIInChI=1S/C18H12O3/c1-11-8-13(10-20-11)18(19)12-6-7-17-15(9-12)14-4-2-3-5-16(14)21-17/h2-10H,1H3
InChIKeyISKBFBPWQCMRRM-UHFFFAOYSA-N
MW276.29 g/mol
LogP4.72
Rot. Bonds2

About dibenzofuran-2-yl-(5-methylfuran-3-yl)methanone

dibenzofuran-2-yl-(5-methylfuran-3-yl)methanone (PubChem CID 114819411) has the molecular formula C18H12O3 and a molecular weight of 276.29 g/mol. Its IUPAC name is dibenzofuran-2-yl-(5-methylfuran-3-yl)methanone.

Molecular Properties

Compound Namedibenzofuran-2-yl-(5-methylfuran-3-yl)methanone
PubChem CID114819411
Molecular FormulaC18H12O3
Molecular Weight276.29 g/mol
Exact Mass276.08
IUPAC Namedibenzofuran-2-yl-(5-methylfuran-3-yl)methanone
SMILESCc1cc(C(=O)c2ccc3oc4ccccc4c3c2)co1
InChIInChI=1S/C18H12O3/c1-11-8-13(10-20-11)18(19)12-6-7-17-15(9-12)14-4-2-3-5-16(14)21-17/h2-10H,1H3
InChIKeyISKBFBPWQCMRRM-UHFFFAOYSA-N
XLogP4.72
TPSA43.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.29
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of dibenzofuran-2-yl-(5-methylfuran-3-yl)methanone?
The IUPAC name of dibenzofuran-2-yl-(5-methylfuran-3-yl)methanone (CID 114819411) is dibenzofuran-2-yl-(5-methylfuran-3-yl)methanone.
What is the SMILES notation for dibenzofuran-2-yl-(5-methylfuran-3-yl)methanone?
The canonical SMILES for dibenzofuran-2-yl-(5-methylfuran-3-yl)methanone is Cc1cc(C(=O)c2ccc3oc4ccccc4c3c2)co1.
What is the InChIKey of dibenzofuran-2-yl-(5-methylfuran-3-yl)methanone?
The InChIKey is ISKBFBPWQCMRRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12O3/c1-11-8-13(10-20-11)18(19)12-6-7-17-15(9-12)14-4-2-3-5-16(14)21-17/h2-10H,1H3.
What are the key properties of dibenzofuran-2-yl-(5-methylfuran-3-yl)methanone?
dibenzofuran-2-yl-(5-methylfuran-3-yl)methanone has a molecular weight of 276.29 g/mol, XLogP of 4.72, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dibenzofuran-2-yl-(5-methylfuran-3-yl)methanone is sourced from PubChem (CID 114819411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).