1-naphthalen-2-yl-3-phenyl-3H-2-benzofuran-1-ol

C24H18O2 — CID 59642868

IUPAC1-naphthalen-2-yl-3-phenyl-3H-2-benzofuran-1-ol
SMILESOC1(c2ccc3ccccc3c2)OC(c2ccccc2)c2ccccc21
InChIInChI=1S/C24H18O2/c25-24(20-15-14-17-8-4-5-11-19(17)16-20)22-13-7-6-12-21(22)23(26-24)18-9-2-1-3-10-18/h1-16,23,25H
InChIKeyNMPXEOAOMIPUMF-UHFFFAOYSA-N
MW338.41 g/mol
LogP5.15
Rot. Bonds2

About 1-naphthalen-2-yl-3-phenyl-3H-2-benzofuran-1-ol

1-naphthalen-2-yl-3-phenyl-3H-2-benzofuran-1-ol (PubChem CID 59642868) has the molecular formula C24H18O2 and a molecular weight of 338.41 g/mol. Its IUPAC name is 1-naphthalen-2-yl-3-phenyl-3H-2-benzofuran-1-ol.

Molecular Properties

Compound Name1-naphthalen-2-yl-3-phenyl-3H-2-benzofuran-1-ol
PubChem CID59642868
Molecular FormulaC24H18O2
Molecular Weight338.41 g/mol
Exact Mass338.13
IUPAC Name1-naphthalen-2-yl-3-phenyl-3H-2-benzofuran-1-ol
SMILESOC1(c2ccc3ccccc3c2)OC(c2ccccc2)c2ccccc21
InChIInChI=1S/C24H18O2/c25-24(20-15-14-17-8-4-5-11-19(17)16-20)22-13-7-6-12-21(22)23(26-24)18-9-2-1-3-10-18/h1-16,23,25H
InChIKeyNMPXEOAOMIPUMF-UHFFFAOYSA-N
XLogP5.15
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.41
LogP ≤ 55.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-yl-3-phenyl-3H-2-benzofuran-1-ol?
The IUPAC name of 1-naphthalen-2-yl-3-phenyl-3H-2-benzofuran-1-ol (CID 59642868) is 1-naphthalen-2-yl-3-phenyl-3H-2-benzofuran-1-ol.
What is the SMILES notation for 1-naphthalen-2-yl-3-phenyl-3H-2-benzofuran-1-ol?
The canonical SMILES for 1-naphthalen-2-yl-3-phenyl-3H-2-benzofuran-1-ol is OC1(c2ccc3ccccc3c2)OC(c2ccccc2)c2ccccc21.
What is the InChIKey of 1-naphthalen-2-yl-3-phenyl-3H-2-benzofuran-1-ol?
The InChIKey is NMPXEOAOMIPUMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18O2/c25-24(20-15-14-17-8-4-5-11-19(17)16-20)22-13-7-6-12-21(22)23(26-24)18-9-2-1-3-10-18/h1-16,23,25H.
What are the key properties of 1-naphthalen-2-yl-3-phenyl-3H-2-benzofuran-1-ol?
1-naphthalen-2-yl-3-phenyl-3H-2-benzofuran-1-ol has a molecular weight of 338.41 g/mol, XLogP of 5.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-yl-3-phenyl-3H-2-benzofuran-1-ol is sourced from PubChem (CID 59642868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).