3-(2,5-dimethyl-4-pyridin-3-ylphenyl)pyridine

C18H16N2 — CID 155748097

IUPAC3-(2,5-dimethyl-4-pyridin-3-ylphenyl)pyridine
SMILESCc1cc(-c2cccnc2)c(C)cc1-c1cccnc1
InChIInChI=1S/C18H16N2/c1-13-9-18(16-6-4-8-20-12-16)14(2)10-17(13)15-5-3-7-19-11-15/h3-12H,1-2H3
InChIKeyPJJFMHCLTJJMKF-UHFFFAOYSA-N
MW260.34 g/mol
LogP4.43
Rot. Bonds2

About 3-(2,5-dimethyl-4-pyridin-3-ylphenyl)pyridine

3-(2,5-dimethyl-4-pyridin-3-ylphenyl)pyridine (PubChem CID 155748097) has the molecular formula C18H16N2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 3-(2,5-dimethyl-4-pyridin-3-ylphenyl)pyridine.

Molecular Properties

Compound Name3-(2,5-dimethyl-4-pyridin-3-ylphenyl)pyridine
PubChem CID155748097
Molecular FormulaC18H16N2
Molecular Weight260.34 g/mol
Exact Mass260.13
IUPAC Name3-(2,5-dimethyl-4-pyridin-3-ylphenyl)pyridine
SMILESCc1cc(-c2cccnc2)c(C)cc1-c1cccnc1
InChIInChI=1S/C18H16N2/c1-13-9-18(16-6-4-8-20-12-16)14(2)10-17(13)15-5-3-7-19-11-15/h3-12H,1-2H3
InChIKeyPJJFMHCLTJJMKF-UHFFFAOYSA-N
XLogP4.43
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4,5-dimethyl-2-pyridin-3-ylphenol
CID 11542953
3-(4-fluoro-5-methyl-2-pyridin-3-ylphenyl)pyridine
CID 46316767
3-(4-chloro-2-methylphenyl)pyridine
CID 46317046
5-methyl-4-phenyl-2-pyridin-3-ylaniline
CID 174549338
3-(2-methylphenyl)pyridine
CID 4133191
3-(2,5-difluoro-4-methylphenyl)pyridine
CID 143759776
3-methyl-2-(3-methyl-4-pyridin-3-ylphenyl)-5-pyridin-3-ylpyridine
CID 102045011
3-[4-(2,2-dimethylpropyl)-2-methylphenyl]pyridine
CID 91541835
3-(2,5-dimethoxy-4-pyridin-3-ylphenyl)pyridine
CID 156631933
3-(2-methyl-3-phenylphenyl)pyridine
CID 91046767
3-(9,9,10,10-tetramethyl-3,6,7-tripyridin-3-ylanthracen-2-yl)pyridine
CID 59649089
3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine
CID 169050404

Frequently Asked Questions

What is the IUPAC name of 3-(2,5-dimethyl-4-pyridin-3-ylphenyl)pyridine?
The IUPAC name of 3-(2,5-dimethyl-4-pyridin-3-ylphenyl)pyridine (CID 155748097) is 3-(2,5-dimethyl-4-pyridin-3-ylphenyl)pyridine.
What is the SMILES notation for 3-(2,5-dimethyl-4-pyridin-3-ylphenyl)pyridine?
The canonical SMILES for 3-(2,5-dimethyl-4-pyridin-3-ylphenyl)pyridine is Cc1cc(-c2cccnc2)c(C)cc1-c1cccnc1.
What is the InChIKey of 3-(2,5-dimethyl-4-pyridin-3-ylphenyl)pyridine?
The InChIKey is PJJFMHCLTJJMKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2/c1-13-9-18(16-6-4-8-20-12-16)14(2)10-17(13)15-5-3-7-19-11-15/h3-12H,1-2H3.
What are the key properties of 3-(2,5-dimethyl-4-pyridin-3-ylphenyl)pyridine?
3-(2,5-dimethyl-4-pyridin-3-ylphenyl)pyridine has a molecular weight of 260.34 g/mol, XLogP of 4.43, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,5-dimethyl-4-pyridin-3-ylphenyl)pyridine is sourced from PubChem (CID 155748097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).