2-[4-(2-phenylmethoxyphenyl)phenyl]furan

C23H18O2 — CID 168526553

IUPAC2-[4-(2-phenylmethoxyphenyl)phenyl]furan
SMILESc1ccc(COc2ccccc2-c2ccc(-c3ccco3)cc2)cc1
InChIInChI=1S/C23H18O2/c1-2-7-18(8-3-1)17-25-23-10-5-4-9-21(23)19-12-14-20(15-13-19)22-11-6-16-24-22/h1-16H,17H2
InChIKeyVZTYRSKKLVCUOG-UHFFFAOYSA-N
MW326.39 g/mol
LogP6.19
Rot. Bonds5

About 2-[4-(2-phenylmethoxyphenyl)phenyl]furan

2-[4-(2-phenylmethoxyphenyl)phenyl]furan (PubChem CID 168526553) has the molecular formula C23H18O2 and a molecular weight of 326.39 g/mol. Its IUPAC name is 2-[4-(2-phenylmethoxyphenyl)phenyl]furan.

Molecular Properties

Compound Name2-[4-(2-phenylmethoxyphenyl)phenyl]furan
PubChem CID168526553
Molecular FormulaC23H18O2
Molecular Weight326.39 g/mol
Exact Mass326.13
IUPAC Name2-[4-(2-phenylmethoxyphenyl)phenyl]furan
SMILESc1ccc(COc2ccccc2-c2ccc(-c3ccco3)cc2)cc1
InChIInChI=1S/C23H18O2/c1-2-7-18(8-3-1)17-25-23-10-5-4-9-21(23)19-12-14-20(15-13-19)22-11-6-16-24-22/h1-16H,17H2
InChIKeyVZTYRSKKLVCUOG-UHFFFAOYSA-N
XLogP6.19
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500326.39
LogP ≤ 56.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-phenylmethoxyphenyl)phenyl]furan?
The IUPAC name of 2-[4-(2-phenylmethoxyphenyl)phenyl]furan (CID 168526553) is 2-[4-(2-phenylmethoxyphenyl)phenyl]furan.
What is the SMILES notation for 2-[4-(2-phenylmethoxyphenyl)phenyl]furan?
The canonical SMILES for 2-[4-(2-phenylmethoxyphenyl)phenyl]furan is c1ccc(COc2ccccc2-c2ccc(-c3ccco3)cc2)cc1.
What is the InChIKey of 2-[4-(2-phenylmethoxyphenyl)phenyl]furan?
The InChIKey is VZTYRSKKLVCUOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18O2/c1-2-7-18(8-3-1)17-25-23-10-5-4-9-21(23)19-12-14-20(15-13-19)22-11-6-16-24-22/h1-16H,17H2.
What are the key properties of 2-[4-(2-phenylmethoxyphenyl)phenyl]furan?
2-[4-(2-phenylmethoxyphenyl)phenyl]furan has a molecular weight of 326.39 g/mol, XLogP of 6.19, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-phenylmethoxyphenyl)phenyl]furan is sourced from PubChem (CID 168526553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).