5-methoxy-2-phenyl-3-[(E)-3-phenylprop-2-enyl]-1-benzofuran

C24H20O2 — CID 132574413

IUPAC5-methoxy-2-phenyl-3-[(E)-3-phenylprop-2-enyl]-1-benzofuran
SMILESCOc1ccc2oc(-c3ccccc3)c(C/C=C/c3ccccc3)c2c1
InChIInChI=1S/C24H20O2/c1-25-20-15-16-23-22(17-20)21(14-8-11-18-9-4-2-5-10-18)24(26-23)19-12-6-3-7-13-19/h2-13,15-17H,14H2,1H3/b11-8+
InChIKeyUCDPNMHJXIHDTK-DHZHZOJOSA-N
MW340.42 g/mol
LogP6.36
Rot. Bonds5

About 5-methoxy-2-phenyl-3-[(E)-3-phenylprop-2-enyl]-1-benzofuran

5-methoxy-2-phenyl-3-[(E)-3-phenylprop-2-enyl]-1-benzofuran (PubChem CID 132574413) has the molecular formula C24H20O2 and a molecular weight of 340.42 g/mol. Its IUPAC name is 5-methoxy-2-phenyl-3-[(E)-3-phenylprop-2-enyl]-1-benzofuran.

Molecular Properties

Compound Name5-methoxy-2-phenyl-3-[(E)-3-phenylprop-2-enyl]-1-benzofuran
PubChem CID132574413
Molecular FormulaC24H20O2
Molecular Weight340.42 g/mol
Exact Mass340.15
IUPAC Name5-methoxy-2-phenyl-3-[(E)-3-phenylprop-2-enyl]-1-benzofuran
SMILESCOc1ccc2oc(-c3ccccc3)c(C/C=C/c3ccccc3)c2c1
InChIInChI=1S/C24H20O2/c1-25-20-15-16-23-22(17-20)21(14-8-11-18-9-4-2-5-10-18)24(26-23)19-12-6-3-7-13-19/h2-13,15-17H,14H2,1H3/b11-8+
InChIKeyUCDPNMHJXIHDTK-DHZHZOJOSA-N
XLogP6.36
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.42
LogP ≤ 56.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(E)-3-(4-methoxyphenyl)prop-2-enyl]-2-phenyl-1-benzofuran
CID 122390967
1-[2-(5-methoxy-2-phenyl-1-benzofuran-3-yl)ethyl]-3-methylurea
CID 10925379
[4-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 5-methoxy-2-phenyl-1-benzofuran-3-carboxylate
CID 6125391
2-bromo-4-methoxy-1-[(E)-3-phenylprop-2-enyl]benzene
CID 141285952
4-methoxy-2-[(Z)-3-phenylprop-2-enyl]phenol
CID 10263673
2-[3-(4-methoxyphenyl)prop-2-enyl]chromen-4-one
CID 70138614
[3-[(E)-3-(4-methylphenyl)-3-oxoprop-1-enyl]phenyl] 5-methoxy-2-phenyl-1-benzofuran-3-carboxylate
CID 6125712
3-bromo-5-methoxy-2-(4-methoxyphenyl)-1-benzofuran
CID 89479970
[4-[(E)-3-(2,5-dimethoxyphenyl)-3-oxoprop-1-enyl]phenyl] 2-methyl-5-phenylmethoxy-1-benzofuran-3-carboxylate
CID 6126309
3-[3-(4-methoxyphenyl)prop-2-ynyl]-2-phenyl-1-benzofuran
CID 15854141
6-methoxy-2-phenylchromen-4-one;hydrate
CID 174958280
5-[(E)-3-phenylprop-2-enoxy]-3-(3,4,5-trimethoxyphenyl)-1-benzofuran
CID 75464734

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-phenyl-3-[(E)-3-phenylprop-2-enyl]-1-benzofuran?
The IUPAC name of 5-methoxy-2-phenyl-3-[(E)-3-phenylprop-2-enyl]-1-benzofuran (CID 132574413) is 5-methoxy-2-phenyl-3-[(E)-3-phenylprop-2-enyl]-1-benzofuran.
What is the SMILES notation for 5-methoxy-2-phenyl-3-[(E)-3-phenylprop-2-enyl]-1-benzofuran?
The canonical SMILES for 5-methoxy-2-phenyl-3-[(E)-3-phenylprop-2-enyl]-1-benzofuran is COc1ccc2oc(-c3ccccc3)c(C/C=C/c3ccccc3)c2c1.
What is the InChIKey of 5-methoxy-2-phenyl-3-[(E)-3-phenylprop-2-enyl]-1-benzofuran?
The InChIKey is UCDPNMHJXIHDTK-DHZHZOJOSA-N. The full InChI is InChI=1S/C24H20O2/c1-25-20-15-16-23-22(17-20)21(14-8-11-18-9-4-2-5-10-18)24(26-23)19-12-6-3-7-13-19/h2-13,15-17H,14H2,1H3/b11-8+.
What are the key properties of 5-methoxy-2-phenyl-3-[(E)-3-phenylprop-2-enyl]-1-benzofuran?
5-methoxy-2-phenyl-3-[(E)-3-phenylprop-2-enyl]-1-benzofuran has a molecular weight of 340.42 g/mol, XLogP of 6.36, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-phenyl-3-[(E)-3-phenylprop-2-enyl]-1-benzofuran is sourced from PubChem (CID 132574413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).