1-(4-hydroxyphenyl)-2-pyridin-3-yl-3H-inden-5-ol

C20H15NO2 — CID 14146270

IUPAC1-(4-hydroxyphenyl)-2-pyridin-3-yl-3H-inden-5-ol
SMILESOc1ccc(C2=C(c3cccnc3)Cc3cc(O)ccc32)cc1
InChIInChI=1S/C20H15NO2/c22-16-5-3-13(4-6-16)20-18-8-7-17(23)10-15(18)11-19(20)14-2-1-9-21-12-14/h1-10,12,22-23H,11H2
InChIKeyXTTOBACUCDXYST-UHFFFAOYSA-N
MW301.35 g/mol
LogP4.01
Rot. Bonds2

About 1-(4-hydroxyphenyl)-2-pyridin-3-yl-3H-inden-5-ol

1-(4-hydroxyphenyl)-2-pyridin-3-yl-3H-inden-5-ol (PubChem CID 14146270) has the molecular formula C20H15NO2 and a molecular weight of 301.35 g/mol. Its IUPAC name is 1-(4-hydroxyphenyl)-2-pyridin-3-yl-3H-inden-5-ol.

Molecular Properties

Compound Name1-(4-hydroxyphenyl)-2-pyridin-3-yl-3H-inden-5-ol
PubChem CID14146270
Molecular FormulaC20H15NO2
Molecular Weight301.35 g/mol
Exact Mass301.11
IUPAC Name1-(4-hydroxyphenyl)-2-pyridin-3-yl-3H-inden-5-ol
SMILESOc1ccc(C2=C(c3cccnc3)Cc3cc(O)ccc32)cc1
InChIInChI=1S/C20H15NO2/c22-16-5-3-13(4-6-16)20-18-8-7-17(23)10-15(18)11-19(20)14-2-1-9-21-12-14/h1-10,12,22-23H,11H2
InChIKeyXTTOBACUCDXYST-UHFFFAOYSA-N
XLogP4.01
TPSA53.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 54.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-hydroxyphenyl)-2-pyridin-3-yl-3H-inden-5-ol?
The IUPAC name of 1-(4-hydroxyphenyl)-2-pyridin-3-yl-3H-inden-5-ol (CID 14146270) is 1-(4-hydroxyphenyl)-2-pyridin-3-yl-3H-inden-5-ol.
What is the SMILES notation for 1-(4-hydroxyphenyl)-2-pyridin-3-yl-3H-inden-5-ol?
The canonical SMILES for 1-(4-hydroxyphenyl)-2-pyridin-3-yl-3H-inden-5-ol is Oc1ccc(C2=C(c3cccnc3)Cc3cc(O)ccc32)cc1.
What is the InChIKey of 1-(4-hydroxyphenyl)-2-pyridin-3-yl-3H-inden-5-ol?
The InChIKey is XTTOBACUCDXYST-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15NO2/c22-16-5-3-13(4-6-16)20-18-8-7-17(23)10-15(18)11-19(20)14-2-1-9-21-12-14/h1-10,12,22-23H,11H2.
What are the key properties of 1-(4-hydroxyphenyl)-2-pyridin-3-yl-3H-inden-5-ol?
1-(4-hydroxyphenyl)-2-pyridin-3-yl-3H-inden-5-ol has a molecular weight of 301.35 g/mol, XLogP of 4.01, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydroxyphenyl)-2-pyridin-3-yl-3H-inden-5-ol is sourced from PubChem (CID 14146270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).