2-[2,3,4-tris(2,3-dimethylphenyl)phenyl]pyridine

C35H33N — CID 140795086

IUPAC2-[2,3,4-tris(2,3-dimethylphenyl)phenyl]pyridine
SMILESCc1cccc(-c2ccc(-c3ccccn3)c(-c3cccc(C)c3C)c2-c2cccc(C)c2C)c1C
InChIInChI=1S/C35H33N/c1-22-12-9-15-28(25(22)4)31-19-20-32(33-18-7-8-21-36-33)35(30-17-11-14-24(3)27(30)6)34(31)29-16-10-13-23(2)26(29)5/h7-21H,1-6H3
InChIKeyGLLVZSKFLQNLGG-UHFFFAOYSA-N
MW467.66 g/mol
LogP9.60
Rot. Bonds4

About 2-[2,3,4-tris(2,3-dimethylphenyl)phenyl]pyridine

2-[2,3,4-tris(2,3-dimethylphenyl)phenyl]pyridine (PubChem CID 140795086) has the molecular formula C35H33N and a molecular weight of 467.66 g/mol. Its IUPAC name is 2-[2,3,4-tris(2,3-dimethylphenyl)phenyl]pyridine.

Molecular Properties

Compound Name2-[2,3,4-tris(2,3-dimethylphenyl)phenyl]pyridine
PubChem CID140795086
Molecular FormulaC35H33N
Molecular Weight467.66 g/mol
Exact Mass467.26
IUPAC Name2-[2,3,4-tris(2,3-dimethylphenyl)phenyl]pyridine
SMILESCc1cccc(-c2ccc(-c3ccccn3)c(-c3cccc(C)c3C)c2-c2cccc(C)c2C)c1C
InChIInChI=1S/C35H33N/c1-22-12-9-15-28(25(22)4)31-19-20-32(33-18-7-8-21-36-33)35(30-17-11-14-24(3)27(30)6)34(31)29-16-10-13-23(2)26(29)5/h7-21H,1-6H3
InChIKeyGLLVZSKFLQNLGG-UHFFFAOYSA-N
XLogP9.60
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500467.66
LogP ≤ 59.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-methylphenyl)pyridine
CID 144596153
2-(2-fluoro-3-methylphenyl)pyridine
CID 175536337
5-(2,3-dimethylphenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine
CID 80521578
2-methyl-3-pyridin-2-ylbenzenethiol
CID 66915624
2-(2,5-dimethyl-4-pyridin-2-ylphenyl)pyridine
CID 118652406
2-(2,4,6-trimethyl-3-pyridin-2-ylphenyl)pyridine
CID 140909024
2-(4-methylthiophen-3-yl)pyridine
CID 89109997
3,4-dimethyl-5-pyridin-2-ylaniline
CID 165495051
2-(2,3-dimethylphenyl)-6-(2-methylphenyl)pyridine
CID 123263739
2-(2,4-dimethylphenyl)pyridine;ethane
CID 143636710
2-(3-butyl-2-methylphenyl)pyridine
CID 161168281
2,3-dipyridin-2-ylpyridine;2,3,4-trimethylpyridine
CID 175182195

Frequently Asked Questions

What is the IUPAC name of 2-[2,3,4-tris(2,3-dimethylphenyl)phenyl]pyridine?
The IUPAC name of 2-[2,3,4-tris(2,3-dimethylphenyl)phenyl]pyridine (CID 140795086) is 2-[2,3,4-tris(2,3-dimethylphenyl)phenyl]pyridine.
What is the SMILES notation for 2-[2,3,4-tris(2,3-dimethylphenyl)phenyl]pyridine?
The canonical SMILES for 2-[2,3,4-tris(2,3-dimethylphenyl)phenyl]pyridine is Cc1cccc(-c2ccc(-c3ccccn3)c(-c3cccc(C)c3C)c2-c2cccc(C)c2C)c1C.
What is the InChIKey of 2-[2,3,4-tris(2,3-dimethylphenyl)phenyl]pyridine?
The InChIKey is GLLVZSKFLQNLGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H33N/c1-22-12-9-15-28(25(22)4)31-19-20-32(33-18-7-8-21-36-33)35(30-17-11-14-24(3)27(30)6)34(31)29-16-10-13-23(2)26(29)5/h7-21H,1-6H3.
What are the key properties of 2-[2,3,4-tris(2,3-dimethylphenyl)phenyl]pyridine?
2-[2,3,4-tris(2,3-dimethylphenyl)phenyl]pyridine has a molecular weight of 467.66 g/mol, XLogP of 9.60, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,3,4-tris(2,3-dimethylphenyl)phenyl]pyridine is sourced from PubChem (CID 140795086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).