2-[4-(3-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-2-yl]phenol

C24H17NO2 — CID 142731316

IUPAC2-[4-(3-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-2-yl]phenol
SMILESOc1cccc(-c2cc(-c3ccccc3O)nc3c2Cc2ccccc2-3)c1
InChIInChI=1S/C24H17NO2/c26-17-8-5-7-15(12-17)20-14-22(19-10-3-4-11-23(19)27)25-24-18-9-2-1-6-16(18)13-21(20)24/h1-12,14,26-27H,13H2
InChIKeyCKOUNCFCSOHWCT-UHFFFAOYSA-N
MW351.41 g/mol
LogP5.40
Rot. Bonds2

About 2-[4-(3-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-2-yl]phenol

2-[4-(3-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-2-yl]phenol (PubChem CID 142731316) has the molecular formula C24H17NO2 and a molecular weight of 351.41 g/mol. Its IUPAC name is 2-[4-(3-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-2-yl]phenol.

Molecular Properties

Compound Name2-[4-(3-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-2-yl]phenol
PubChem CID142731316
Molecular FormulaC24H17NO2
Molecular Weight351.41 g/mol
Exact Mass351.13
IUPAC Name2-[4-(3-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-2-yl]phenol
SMILESOc1cccc(-c2cc(-c3ccccc3O)nc3c2Cc2ccccc2-3)c1
InChIInChI=1S/C24H17NO2/c26-17-8-5-7-15(12-17)20-14-22(19-10-3-4-11-23(19)27)25-24-18-9-2-1-6-16(18)13-21(20)24/h1-12,14,26-27H,13H2
InChIKeyCKOUNCFCSOHWCT-UHFFFAOYSA-N
XLogP5.40
TPSA53.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.41
LogP ≤ 55.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(3-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-2-yl]phenol?
The IUPAC name of 2-[4-(3-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-2-yl]phenol (CID 142731316) is 2-[4-(3-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-2-yl]phenol.
What is the SMILES notation for 2-[4-(3-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-2-yl]phenol?
The canonical SMILES for 2-[4-(3-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-2-yl]phenol is Oc1cccc(-c2cc(-c3ccccc3O)nc3c2Cc2ccccc2-3)c1.
What is the InChIKey of 2-[4-(3-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-2-yl]phenol?
The InChIKey is CKOUNCFCSOHWCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17NO2/c26-17-8-5-7-15(12-17)20-14-22(19-10-3-4-11-23(19)27)25-24-18-9-2-1-6-16(18)13-21(20)24/h1-12,14,26-27H,13H2.
What are the key properties of 2-[4-(3-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-2-yl]phenol?
2-[4-(3-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-2-yl]phenol has a molecular weight of 351.41 g/mol, XLogP of 5.40, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(3-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-2-yl]phenol is sourced from PubChem (CID 142731316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).