5-(2,3-dipyridin-2-yl-4-pyridinyl)benzene-1,3-diol

C21H15N3O2 — CID 23500275

IUPAC5-(2,3-dipyridin-2-yl-4-pyridinyl)benzene-1,3-diol
SMILESOc1cc(O)cc(-c2ccnc(-c3ccccn3)c2-c2ccccn2)c1
InChIInChI=1S/C21H15N3O2/c25-15-11-14(12-16(26)13-15)17-7-10-24-21(19-6-2-4-9-23-19)20(17)18-5-1-3-8-22-18/h1-13,25-26H
InChIKeyWKJUKRDMCIVROH-UHFFFAOYSA-N
MW341.37 g/mol
LogP4.28
Rot. Bonds3

About 5-(2,3-dipyridin-2-yl-4-pyridinyl)benzene-1,3-diol

5-(2,3-dipyridin-2-yl-4-pyridinyl)benzene-1,3-diol (PubChem CID 23500275) has the molecular formula C21H15N3O2 and a molecular weight of 341.37 g/mol. Its IUPAC name is 5-(2,3-dipyridin-2-yl-4-pyridinyl)benzene-1,3-diol.

Molecular Properties

Compound Name5-(2,3-dipyridin-2-yl-4-pyridinyl)benzene-1,3-diol
PubChem CID23500275
Molecular FormulaC21H15N3O2
Molecular Weight341.37 g/mol
Exact Mass341.12
IUPAC Name5-(2,3-dipyridin-2-yl-4-pyridinyl)benzene-1,3-diol
SMILESOc1cc(O)cc(-c2ccnc(-c3ccccn3)c2-c2ccccn2)c1
InChIInChI=1S/C21H15N3O2/c25-15-11-14(12-16(26)13-15)17-7-10-24-21(19-6-2-4-9-23-19)20(17)18-5-1-3-8-22-18/h1-13,25-26H
InChIKeyWKJUKRDMCIVROH-UHFFFAOYSA-N
XLogP4.28
TPSA79.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 54.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(1H-imidazol-2-yl)-2,3-dipyridin-2-ylpyridine
CID 123457191
(2,3-dipyridin-2-yl-4-pyridinyl)phosphane
CID 123336699
2-[3-[2-[2-(3,5-dipyridin-2-ylphenyl)phenyl]phenyl]-5-pyridin-2-ylphenyl]pyridine
CID 71534257
4-methyl-2-pyridin-2-ylpyridin-3-ol
CID 142200360
2,3-dipyridin-2-ylpyridine-4-carboxamide
CID 141257158
2,3,4,5-tetrapyridin-2-ylpyridine
CID 22045955
2-chloro-4-phenyl-3-pyridin-2-ylpyridine
CID 174953397
bis(iridium);tetrakis(4-pyridin-2-ylphenol)
CID 173084104
2,3-dipyridin-2-ylpyridine;platinum
CID 87064106
1,1'-biphenyl;2,3-dipyridin-2-ylpyridine
CID 67006222
1,9-dipyridin-2-ylpyrido[4,3-g]isoquinoline
CID 102186037
2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol
CID 137091036

Frequently Asked Questions

What is the IUPAC name of 5-(2,3-dipyridin-2-yl-4-pyridinyl)benzene-1,3-diol?
The IUPAC name of 5-(2,3-dipyridin-2-yl-4-pyridinyl)benzene-1,3-diol (CID 23500275) is 5-(2,3-dipyridin-2-yl-4-pyridinyl)benzene-1,3-diol.
What is the SMILES notation for 5-(2,3-dipyridin-2-yl-4-pyridinyl)benzene-1,3-diol?
The canonical SMILES for 5-(2,3-dipyridin-2-yl-4-pyridinyl)benzene-1,3-diol is Oc1cc(O)cc(-c2ccnc(-c3ccccn3)c2-c2ccccn2)c1.
What is the InChIKey of 5-(2,3-dipyridin-2-yl-4-pyridinyl)benzene-1,3-diol?
The InChIKey is WKJUKRDMCIVROH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15N3O2/c25-15-11-14(12-16(26)13-15)17-7-10-24-21(19-6-2-4-9-23-19)20(17)18-5-1-3-8-22-18/h1-13,25-26H.
What are the key properties of 5-(2,3-dipyridin-2-yl-4-pyridinyl)benzene-1,3-diol?
5-(2,3-dipyridin-2-yl-4-pyridinyl)benzene-1,3-diol has a molecular weight of 341.37 g/mol, XLogP of 4.28, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,3-dipyridin-2-yl-4-pyridinyl)benzene-1,3-diol is sourced from PubChem (CID 23500275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).