2,4,6-tripyridin-4-ylphenol

C21H15N3O — CID 141364180

IUPAC2,4,6-tripyridin-4-ylphenol
SMILESOc1c(-c2ccncc2)cc(-c2ccncc2)cc1-c1ccncc1
InChIInChI=1S/C21H15N3O/c25-21-19(16-3-9-23-10-4-16)13-18(15-1-7-22-8-2-15)14-20(21)17-5-11-24-12-6-17/h1-14,25H
InChIKeyZLTIHQDJUGEQAV-UHFFFAOYSA-N
MW325.37 g/mol
LogP4.58
Rot. Bonds3

About 2,4,6-tripyridin-4-ylphenol

2,4,6-tripyridin-4-ylphenol (PubChem CID 141364180) has the molecular formula C21H15N3O and a molecular weight of 325.37 g/mol. Its IUPAC name is 2,4,6-tripyridin-4-ylphenol.

Molecular Properties

Compound Name2,4,6-tripyridin-4-ylphenol
PubChem CID141364180
Molecular FormulaC21H15N3O
Molecular Weight325.37 g/mol
Exact Mass325.12
IUPAC Name2,4,6-tripyridin-4-ylphenol
SMILESOc1c(-c2ccncc2)cc(-c2ccncc2)cc1-c1ccncc1
InChIInChI=1S/C21H15N3O/c25-21-19(16-3-9-23-10-4-16)13-18(15-1-7-22-8-2-15)14-20(21)17-5-11-24-12-6-17/h1-14,25H
InChIKeyZLTIHQDJUGEQAV-UHFFFAOYSA-N
XLogP4.58
TPSA58.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-phenyl-2,6-dipyridin-4-ylpyridin-1-ium-1-yl)-2,6-dipyridin-4-ylphenol
CID 135404283
2,6-diphenyl-4-pyridin-4-ylaniline
CID 11209480
gold;4-pyridin-4-ylpyridine
CID 159917709
ethanol;4-(2,4,5-tripyridin-4-ylphenyl)pyridine
CID 139144971
4-[4-[2,4-diphenyl-5-(4-pyridin-4-ylphenyl)phenyl]phenyl]pyridine
CID 67990612
4-[2-[1,2,2-tris(2-pyridin-4-ylphenyl)ethenyl]phenyl]pyridine
CID 123619493
4-pyridin-4-ylbenzene-1,2-diol
CID 604349
ethane;4-pyridin-4-ylpyridine
CID 142013036
4-chloro-3-pyridin-4-ylphenol
CID 46316948
3-fluoro-4-pyridin-4-ylphenol
CID 135740652
bis(3,5-dipyridin-4-ylphenyl)methanone
CID 58240129
bis(3,5-dibromophenol);4-pyridin-4-ylpyridine
CID 139187304

Frequently Asked Questions

What is the IUPAC name of 2,4,6-tripyridin-4-ylphenol?
The IUPAC name of 2,4,6-tripyridin-4-ylphenol (CID 141364180) is 2,4,6-tripyridin-4-ylphenol.
What is the SMILES notation for 2,4,6-tripyridin-4-ylphenol?
The canonical SMILES for 2,4,6-tripyridin-4-ylphenol is Oc1c(-c2ccncc2)cc(-c2ccncc2)cc1-c1ccncc1.
What is the InChIKey of 2,4,6-tripyridin-4-ylphenol?
The InChIKey is ZLTIHQDJUGEQAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15N3O/c25-21-19(16-3-9-23-10-4-16)13-18(15-1-7-22-8-2-15)14-20(21)17-5-11-24-12-6-17/h1-14,25H.
What are the key properties of 2,4,6-tripyridin-4-ylphenol?
2,4,6-tripyridin-4-ylphenol has a molecular weight of 325.37 g/mol, XLogP of 4.58, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6-tripyridin-4-ylphenol is sourced from PubChem (CID 141364180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).