2-phenyl-4-pyridin-4-yl-5H-indeno[1,2-b]pyridine

C23H16N2 — CID 122183816

IUPAC2-phenyl-4-pyridin-4-yl-5H-indeno[1,2-b]pyridine
SMILESc1ccc(-c2cc(-c3ccncc3)c3c(n2)-c2ccccc2C3)cc1
InChIInChI=1S/C23H16N2/c1-2-6-17(7-3-1)22-15-20(16-10-12-24-13-11-16)21-14-18-8-4-5-9-19(18)23(21)25-22/h1-13,15H,14H2
InChIKeyJMHSWFBZJRZBHO-UHFFFAOYSA-N
MW320.40 g/mol
LogP5.38
Rot. Bonds2

About 2-phenyl-4-pyridin-4-yl-5H-indeno[1,2-b]pyridine

2-phenyl-4-pyridin-4-yl-5H-indeno[1,2-b]pyridine (PubChem CID 122183816) has the molecular formula C23H16N2 and a molecular weight of 320.40 g/mol. Its IUPAC name is 2-phenyl-4-pyridin-4-yl-5H-indeno[1,2-b]pyridine.

Molecular Properties

Compound Name2-phenyl-4-pyridin-4-yl-5H-indeno[1,2-b]pyridine
PubChem CID122183816
Molecular FormulaC23H16N2
Molecular Weight320.40 g/mol
Exact Mass320.13
IUPAC Name2-phenyl-4-pyridin-4-yl-5H-indeno[1,2-b]pyridine
SMILESc1ccc(-c2cc(-c3ccncc3)c3c(n2)-c2ccccc2C3)cc1
InChIInChI=1S/C23H16N2/c1-2-6-17(7-3-1)22-15-20(16-10-12-24-13-11-16)21-14-18-8-4-5-9-19(18)23(21)25-22/h1-13,15H,14H2
InChIKeyJMHSWFBZJRZBHO-UHFFFAOYSA-N
XLogP5.38
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.40
LogP ≤ 55.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-4-pyridin-4-yl-5H-indeno[1,2-b]pyridine?
The IUPAC name of 2-phenyl-4-pyridin-4-yl-5H-indeno[1,2-b]pyridine (CID 122183816) is 2-phenyl-4-pyridin-4-yl-5H-indeno[1,2-b]pyridine.
What is the SMILES notation for 2-phenyl-4-pyridin-4-yl-5H-indeno[1,2-b]pyridine?
The canonical SMILES for 2-phenyl-4-pyridin-4-yl-5H-indeno[1,2-b]pyridine is c1ccc(-c2cc(-c3ccncc3)c3c(n2)-c2ccccc2C3)cc1.
What is the InChIKey of 2-phenyl-4-pyridin-4-yl-5H-indeno[1,2-b]pyridine?
The InChIKey is JMHSWFBZJRZBHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16N2/c1-2-6-17(7-3-1)22-15-20(16-10-12-24-13-11-16)21-14-18-8-4-5-9-19(18)23(21)25-22/h1-13,15H,14H2.
What are the key properties of 2-phenyl-4-pyridin-4-yl-5H-indeno[1,2-b]pyridine?
2-phenyl-4-pyridin-4-yl-5H-indeno[1,2-b]pyridine has a molecular weight of 320.40 g/mol, XLogP of 5.38, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-4-pyridin-4-yl-5H-indeno[1,2-b]pyridine is sourced from PubChem (CID 122183816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).