2-[(E)-2-(furan-2-yl)ethenyl]-3-[(E)-2-(4-methylphenyl)ethenyl]furan

C19H16O2 — CID 102386910

IUPAC2-[(E)-2-(furan-2-yl)ethenyl]-3-[(E)-2-(4-methylphenyl)ethenyl]furan
SMILESCc1ccc(/C=C/c2ccoc2/C=C/c2ccco2)cc1
InChIInChI=1S/C19H16O2/c1-15-4-6-16(7-5-15)8-9-17-12-14-21-19(17)11-10-18-3-2-13-20-18/h2-14H,1H3/b9-8+,11-10+
InChIKeyRDFPCVYJJBVZRU-BNFZFUHLSA-N
MW276.33 g/mol
LogP5.52
Rot. Bonds4

About 2-[(E)-2-(furan-2-yl)ethenyl]-3-[(E)-2-(4-methylphenyl)ethenyl]furan

2-[(E)-2-(furan-2-yl)ethenyl]-3-[(E)-2-(4-methylphenyl)ethenyl]furan (PubChem CID 102386910) has the molecular formula C19H16O2 and a molecular weight of 276.33 g/mol. Its IUPAC name is 2-[(E)-2-(furan-2-yl)ethenyl]-3-[(E)-2-(4-methylphenyl)ethenyl]furan.

Molecular Properties

Compound Name2-[(E)-2-(furan-2-yl)ethenyl]-3-[(E)-2-(4-methylphenyl)ethenyl]furan
PubChem CID102386910
Molecular FormulaC19H16O2
Molecular Weight276.33 g/mol
Exact Mass276.12
IUPAC Name2-[(E)-2-(furan-2-yl)ethenyl]-3-[(E)-2-(4-methylphenyl)ethenyl]furan
SMILESCc1ccc(/C=C/c2ccoc2/C=C/c2ccco2)cc1
InChIInChI=1S/C19H16O2/c1-15-4-6-16(7-5-15)8-9-17-12-14-21-19(17)11-10-18-3-2-13-20-18/h2-14H,1H3/b9-8+,11-10+
InChIKeyRDFPCVYJJBVZRU-BNFZFUHLSA-N
XLogP5.52
TPSA26.28 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.33
LogP ≤ 55.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-(furan-2-yl)ethenyl]-3-[(E)-2-(4-methylphenyl)ethenyl]furan?
The IUPAC name of 2-[(E)-2-(furan-2-yl)ethenyl]-3-[(E)-2-(4-methylphenyl)ethenyl]furan (CID 102386910) is 2-[(E)-2-(furan-2-yl)ethenyl]-3-[(E)-2-(4-methylphenyl)ethenyl]furan.
What is the SMILES notation for 2-[(E)-2-(furan-2-yl)ethenyl]-3-[(E)-2-(4-methylphenyl)ethenyl]furan?
The canonical SMILES for 2-[(E)-2-(furan-2-yl)ethenyl]-3-[(E)-2-(4-methylphenyl)ethenyl]furan is Cc1ccc(/C=C/c2ccoc2/C=C/c2ccco2)cc1.
What is the InChIKey of 2-[(E)-2-(furan-2-yl)ethenyl]-3-[(E)-2-(4-methylphenyl)ethenyl]furan?
The InChIKey is RDFPCVYJJBVZRU-BNFZFUHLSA-N. The full InChI is InChI=1S/C19H16O2/c1-15-4-6-16(7-5-15)8-9-17-12-14-21-19(17)11-10-18-3-2-13-20-18/h2-14H,1H3/b9-8+,11-10+.
What are the key properties of 2-[(E)-2-(furan-2-yl)ethenyl]-3-[(E)-2-(4-methylphenyl)ethenyl]furan?
2-[(E)-2-(furan-2-yl)ethenyl]-3-[(E)-2-(4-methylphenyl)ethenyl]furan has a molecular weight of 276.33 g/mol, XLogP of 5.52, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-(furan-2-yl)ethenyl]-3-[(E)-2-(4-methylphenyl)ethenyl]furan is sourced from PubChem (CID 102386910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).