1,1'-biphenyl;2,3-dipyridin-2-ylpyridine

C27H21N3 — CID 67006222

IUPAC1,1'-biphenyl;2,3-dipyridin-2-ylpyridine
SMILESc1ccc(-c2ccccc2)cc1.c1ccc(-c2cccnc2-c2ccccn2)nc1
InChIInChI=1S/C15H11N3.C12H10/c1-3-9-16-13(7-1)12-6-5-11-18-15(12)14-8-2-4-10-17-14;1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-11H;1-10H
InChIKeyVSDAUOYWTDTMJI-UHFFFAOYSA-N
MW387.49 g/mol
LogP6.56
Rot. Bonds3

About 1,1'-biphenyl;2,3-dipyridin-2-ylpyridine

1,1'-biphenyl;2,3-dipyridin-2-ylpyridine (PubChem CID 67006222) has the molecular formula C27H21N3 and a molecular weight of 387.49 g/mol. Its IUPAC name is 1,1'-biphenyl;2,3-dipyridin-2-ylpyridine.

Molecular Properties

Compound Name1,1'-biphenyl;2,3-dipyridin-2-ylpyridine
PubChem CID67006222
Molecular FormulaC27H21N3
Molecular Weight387.49 g/mol
Exact Mass387.17
IUPAC Name1,1'-biphenyl;2,3-dipyridin-2-ylpyridine
SMILESc1ccc(-c2ccccc2)cc1.c1ccc(-c2cccnc2-c2ccccn2)nc1
InChIInChI=1S/C15H11N3.C12H10/c1-3-9-16-13(7-1)12-6-5-11-18-15(12)14-8-2-4-10-17-14;1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-11H;1-10H
InChIKeyVSDAUOYWTDTMJI-UHFFFAOYSA-N
XLogP6.56
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.49
LogP ≤ 56.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dipyridin-2-ylpyridine;platinum
CID 87064106
copper;2,3-dipyridin-2-ylpyridine;2-pyridin-2-ylpyridine
CID 175437011
N,N-diphenylaniline;2,3-dipyridin-2-ylpyridine;manganese
CID 174834499
2,3-dipyridin-2-ylpyridine;hydroxymethanone;ruthenium(3+)
CID 87404819
zinc;2,3-dipyridin-2-ylpyridine;sulfate
CID 175077808
2-(3-pyridin-2-yl-2-pyridinyl)pyrimidine
CID 175779710
3-chloro-2-(2-pyridin-2-yl-3-pyridinyl)pyridine;platinum
CID 174998180
3-(4-methylphenyl)-2-pyridin-2-ylpyridine
CID 138756955
2-(3-chlorophenyl)-3-pyridin-2-ylpyridine
CID 90094366
2-(3-pyridin-2-yl-2-pyridinyl)pyridin-3-amine
CID 67060209
2,3-dipyridin-2-ylpyridine;2,3,4-trimethylpyridine
CID 175182195
3-phenyl-2-(2-pyridin-2-yl-3-pyridinyl)-1H-pyridine-4-thione
CID 69074303

Frequently Asked Questions

What is the IUPAC name of 1,1'-biphenyl;2,3-dipyridin-2-ylpyridine?
The IUPAC name of 1,1'-biphenyl;2,3-dipyridin-2-ylpyridine (CID 67006222) is 1,1'-biphenyl;2,3-dipyridin-2-ylpyridine.
What is the SMILES notation for 1,1'-biphenyl;2,3-dipyridin-2-ylpyridine?
The canonical SMILES for 1,1'-biphenyl;2,3-dipyridin-2-ylpyridine is c1ccc(-c2ccccc2)cc1.c1ccc(-c2cccnc2-c2ccccn2)nc1.
What is the InChIKey of 1,1'-biphenyl;2,3-dipyridin-2-ylpyridine?
The InChIKey is VSDAUOYWTDTMJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3.C12H10/c1-3-9-16-13(7-1)12-6-5-11-18-15(12)14-8-2-4-10-17-14;1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-11H;1-10H.
What are the key properties of 1,1'-biphenyl;2,3-dipyridin-2-ylpyridine?
1,1'-biphenyl;2,3-dipyridin-2-ylpyridine has a molecular weight of 387.49 g/mol, XLogP of 6.56, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1'-biphenyl;2,3-dipyridin-2-ylpyridine is sourced from PubChem (CID 67006222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).