2-(2-pyridin-4-yl-5H-indeno[1,2-b]pyridin-4-yl)phenol

C23H16N2O — CID 137317442

IUPAC2-(2-pyridin-4-yl-5H-indeno[1,2-b]pyridin-4-yl)phenol
SMILESOc1ccccc1-c1cc(-c2ccncc2)nc2c1Cc1ccccc1-2
InChIInChI=1S/C23H16N2O/c26-22-8-4-3-7-18(22)19-14-21(15-9-11-24-12-10-15)25-23-17-6-2-1-5-16(17)13-20(19)23/h1-12,14,26H,13H2
InChIKeyPHBHRSIWSBXMIU-UHFFFAOYSA-N
MW336.39 g/mol
LogP5.09
Rot. Bonds2

About 2-(2-pyridin-4-yl-5H-indeno[1,2-b]pyridin-4-yl)phenol

2-(2-pyridin-4-yl-5H-indeno[1,2-b]pyridin-4-yl)phenol (PubChem CID 137317442) has the molecular formula C23H16N2O and a molecular weight of 336.39 g/mol. Its IUPAC name is 2-(2-pyridin-4-yl-5H-indeno[1,2-b]pyridin-4-yl)phenol.

Molecular Properties

Compound Name2-(2-pyridin-4-yl-5H-indeno[1,2-b]pyridin-4-yl)phenol
PubChem CID137317442
Molecular FormulaC23H16N2O
Molecular Weight336.39 g/mol
Exact Mass336.13
IUPAC Name2-(2-pyridin-4-yl-5H-indeno[1,2-b]pyridin-4-yl)phenol
SMILESOc1ccccc1-c1cc(-c2ccncc2)nc2c1Cc1ccccc1-2
InChIInChI=1S/C23H16N2O/c26-22-8-4-3-7-18(22)19-14-21(15-9-11-24-12-10-15)25-23-17-6-2-1-5-16(17)13-20(19)23/h1-12,14,26H,13H2
InChIKeyPHBHRSIWSBXMIU-UHFFFAOYSA-N
XLogP5.09
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.39
LogP ≤ 55.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-pyridin-4-yl-5H-indeno[1,2-b]pyridin-4-yl)phenol?
The IUPAC name of 2-(2-pyridin-4-yl-5H-indeno[1,2-b]pyridin-4-yl)phenol (CID 137317442) is 2-(2-pyridin-4-yl-5H-indeno[1,2-b]pyridin-4-yl)phenol.
What is the SMILES notation for 2-(2-pyridin-4-yl-5H-indeno[1,2-b]pyridin-4-yl)phenol?
The canonical SMILES for 2-(2-pyridin-4-yl-5H-indeno[1,2-b]pyridin-4-yl)phenol is Oc1ccccc1-c1cc(-c2ccncc2)nc2c1Cc1ccccc1-2.
What is the InChIKey of 2-(2-pyridin-4-yl-5H-indeno[1,2-b]pyridin-4-yl)phenol?
The InChIKey is PHBHRSIWSBXMIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16N2O/c26-22-8-4-3-7-18(22)19-14-21(15-9-11-24-12-10-15)25-23-17-6-2-1-5-16(17)13-20(19)23/h1-12,14,26H,13H2.
What are the key properties of 2-(2-pyridin-4-yl-5H-indeno[1,2-b]pyridin-4-yl)phenol?
2-(2-pyridin-4-yl-5H-indeno[1,2-b]pyridin-4-yl)phenol has a molecular weight of 336.39 g/mol, XLogP of 5.09, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-pyridin-4-yl-5H-indeno[1,2-b]pyridin-4-yl)phenol is sourced from PubChem (CID 137317442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).