2-(2-chlorophenyl)-4-(4-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-9-ol

C₂₄H₁₆ClNO₂ — CID 155513405

About 2-(2-chlorophenyl)-4-(4-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-9-ol

2-(2-chlorophenyl)-4-(4-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-9-ol (PubChem CID 155513405) has the molecular formula C₂₄H₁₆ClNO₂ and a molecular weight of 385.85 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-4-(4-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-9-ol.

Molecular Properties

• Compound Name: 2-(2-chlorophenyl)-4-(4-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-9-ol
• PubChem CID: 155513405
• Molecular Formula: C₂₄H₁₆ClNO₂
• Molecular Weight: 385.85 g/mol
• Exact Mass: 385.09
• IUPAC Name: 2-(2-chlorophenyl)-4-(4-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-9-ol
• SMILES: Oc1ccc(-c2cc(-c3ccccc3Cl)nc3c2Cc2cccc(O)c2-3)cc1
• InChI: InChI=1S/C24H16ClNO2/c25-20-6-2-1-5-17(20)21-13-18(14-8-10-16(27)11-9-14)19-12-15-4-3-7-22(28)23(15)24(19)26-21/h1-11,13,27-28H,12H2
• InChIKey: IJJXWMMNUWOQMH-UHFFFAOYSA-N
• XLogP: 6.05
• TPSA: 53.35 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 3
• Rotatable Bonds: 2
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	385.85
LogP ≤ 5	6.05
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-4-(4-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-9-ol?

The IUPAC name of 2-(2-chlorophenyl)-4-(4-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-9-ol (CID 155513405) is 2-(2-chlorophenyl)-4-(4-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-9-ol.

What is the SMILES notation for 2-(2-chlorophenyl)-4-(4-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-9-ol?

The canonical SMILES for 2-(2-chlorophenyl)-4-(4-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-9-ol is Oc1ccc(-c2cc(-c3ccccc3Cl)nc3c2Cc2cccc(O)c2-3)cc1.

What is the InChIKey of 2-(2-chlorophenyl)-4-(4-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-9-ol?

The InChIKey is IJJXWMMNUWOQMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16ClNO2/c25-20-6-2-1-5-17(20)21-13-18(14-8-10-16(27)11-9-14)19-12-15-4-3-7-22(28)23(15)24(19)26-21/h1-11,13,27-28H,12H2.

What are the key properties of 2-(2-chlorophenyl)-4-(4-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-9-ol?

2-(2-chlorophenyl)-4-(4-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-9-ol has a molecular weight of 385.85 g/mol, XLogP of 6.05, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2-chlorophenyl)-4-(4-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-9-ol is sourced from PubChem (CID 155513405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 155513405 — identifiers, structure, computed properties (public domain)

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