5-[4-(2-hydroxyphenyl)cyclopenta-1,4-dien-1-yl]-1H-inden-1-ol

C20H16O2 — CID 156521847

IUPAC5-[4-(2-hydroxyphenyl)cyclopenta-1,4-dien-1-yl]-1H-inden-1-ol
SMILESOc1ccccc1C1=CC(c2ccc3c(c2)C=CC3O)=CC1
InChIInChI=1S/C20H16O2/c21-19-4-2-1-3-17(19)15-6-5-13(11-15)14-7-9-18-16(12-14)8-10-20(18)22/h1-5,7-12,20-22H,6H2
InChIKeyHSJQNNDLXIOCEX-UHFFFAOYSA-N
MW288.35 g/mol
LogP4.32
Rot. Bonds2

About 5-[4-(2-hydroxyphenyl)cyclopenta-1,4-dien-1-yl]-1H-inden-1-ol

5-[4-(2-hydroxyphenyl)cyclopenta-1,4-dien-1-yl]-1H-inden-1-ol (PubChem CID 156521847) has the molecular formula C20H16O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 5-[4-(2-hydroxyphenyl)cyclopenta-1,4-dien-1-yl]-1H-inden-1-ol.

Molecular Properties

Compound Name5-[4-(2-hydroxyphenyl)cyclopenta-1,4-dien-1-yl]-1H-inden-1-ol
PubChem CID156521847
Molecular FormulaC20H16O2
Molecular Weight288.35 g/mol
Exact Mass288.12
IUPAC Name5-[4-(2-hydroxyphenyl)cyclopenta-1,4-dien-1-yl]-1H-inden-1-ol
SMILESOc1ccccc1C1=CC(c2ccc3c(c2)C=CC3O)=CC1
InChIInChI=1S/C20H16O2/c21-19-4-2-1-3-17(19)15-6-5-13(11-15)14-7-9-18-16(12-14)8-10-20(18)22/h1-5,7-12,20-22H,6H2
InChIKeyHSJQNNDLXIOCEX-UHFFFAOYSA-N
XLogP4.32
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 54.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-[4-(2-hydroxyphenyl)cyclopenta-1,4-dien-1-yl]-1H-inden-1-ol?
The IUPAC name of 5-[4-(2-hydroxyphenyl)cyclopenta-1,4-dien-1-yl]-1H-inden-1-ol (CID 156521847) is 5-[4-(2-hydroxyphenyl)cyclopenta-1,4-dien-1-yl]-1H-inden-1-ol.
What is the SMILES notation for 5-[4-(2-hydroxyphenyl)cyclopenta-1,4-dien-1-yl]-1H-inden-1-ol?
The canonical SMILES for 5-[4-(2-hydroxyphenyl)cyclopenta-1,4-dien-1-yl]-1H-inden-1-ol is Oc1ccccc1C1=CC(c2ccc3c(c2)C=CC3O)=CC1.
What is the InChIKey of 5-[4-(2-hydroxyphenyl)cyclopenta-1,4-dien-1-yl]-1H-inden-1-ol?
The InChIKey is HSJQNNDLXIOCEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16O2/c21-19-4-2-1-3-17(19)15-6-5-13(11-15)14-7-9-18-16(12-14)8-10-20(18)22/h1-5,7-12,20-22H,6H2.
What are the key properties of 5-[4-(2-hydroxyphenyl)cyclopenta-1,4-dien-1-yl]-1H-inden-1-ol?
5-[4-(2-hydroxyphenyl)cyclopenta-1,4-dien-1-yl]-1H-inden-1-ol has a molecular weight of 288.35 g/mol, XLogP of 4.32, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(2-hydroxyphenyl)cyclopenta-1,4-dien-1-yl]-1H-inden-1-ol is sourced from PubChem (CID 156521847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).