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

C18H16N2O2 — CID 156631933

IUPAC3-(2,5-dimethoxy-4-pyridin-3-ylphenyl)pyridine
SMILESCOc1cc(-c2cccnc2)c(OC)cc1-c1cccnc1
InChIInChI=1S/C18H16N2O2/c1-21-17-9-16(14-6-4-8-20-12-14)18(22-2)10-15(17)13-5-3-7-19-11-13/h3-12H,1-2H3
InChIKeyZXHVJAPMJNWUFN-UHFFFAOYSA-N
MW292.34 g/mol
LogP3.83
Rot. Bonds4

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

3-(2,5-dimethoxy-4-pyridin-3-ylphenyl)pyridine (PubChem CID 156631933) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is 3-(2,5-dimethoxy-4-pyridin-3-ylphenyl)pyridine.

Molecular Properties

Compound Name3-(2,5-dimethoxy-4-pyridin-3-ylphenyl)pyridine
PubChem CID156631933
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Name3-(2,5-dimethoxy-4-pyridin-3-ylphenyl)pyridine
SMILESCOc1cc(-c2cccnc2)c(OC)cc1-c1cccnc1
InChIInChI=1S/C18H16N2O2/c1-21-17-9-16(14-6-4-8-20-12-14)18(22-2)10-15(17)13-5-3-7-19-11-13/h3-12H,1-2H3
InChIKeyZXHVJAPMJNWUFN-UHFFFAOYSA-N
XLogP3.83
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2,4-dimethoxyphenyl)pyridine
CID 46316965
3-(5-fluoro-2-methoxy-4-methylphenyl)pyridine
CID 158694980
3-(5-ethoxy-2-methoxy-4-methylphenyl)pyridine
CID 159955267
3-(2-methoxyphenyl)pyridine
CID 4133297
2-chloro-4-methoxy-5-pyridin-3-ylpyridine
CID 175166261
3-[2-methoxy-4-(trifluoromethyl)phenyl]pyridine
CID 46317325
5-methoxy-6-pyridin-3-yl-2,3-dihydroisoindol-1-one
CID 140925375
3-(2,3-dimethoxyphenyl)pyridine
CID 22001178
methyl 4-methoxy-3-pyridin-3-ylbenzoate
CID 46317451
3-(3,4,5-trimethoxyphenyl)pyridine
CID 141070241
3-(2-methoxy-3-pyridin-3-ylphenyl)pyridine
CID 46316374
3-(2,6-dimethoxy-4-pyridin-3-ylnaphthalen-1-yl)pyridine
CID 169050278

Frequently Asked Questions

What is the IUPAC name of 3-(2,5-dimethoxy-4-pyridin-3-ylphenyl)pyridine?
The IUPAC name of 3-(2,5-dimethoxy-4-pyridin-3-ylphenyl)pyridine (CID 156631933) is 3-(2,5-dimethoxy-4-pyridin-3-ylphenyl)pyridine.
What is the SMILES notation for 3-(2,5-dimethoxy-4-pyridin-3-ylphenyl)pyridine?
The canonical SMILES for 3-(2,5-dimethoxy-4-pyridin-3-ylphenyl)pyridine is COc1cc(-c2cccnc2)c(OC)cc1-c1cccnc1.
What is the InChIKey of 3-(2,5-dimethoxy-4-pyridin-3-ylphenyl)pyridine?
The InChIKey is ZXHVJAPMJNWUFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-21-17-9-16(14-6-4-8-20-12-14)18(22-2)10-15(17)13-5-3-7-19-11-13/h3-12H,1-2H3.
What are the key properties of 3-(2,5-dimethoxy-4-pyridin-3-ylphenyl)pyridine?
3-(2,5-dimethoxy-4-pyridin-3-ylphenyl)pyridine has a molecular weight of 292.34 g/mol, XLogP of 3.83, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,5-dimethoxy-4-pyridin-3-ylphenyl)pyridine is sourced from PubChem (CID 156631933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).