2-(3,5-dimethoxyphenyl)-3-(2-pyridin-2-ylethoxy)pyridine

C20H20N2O3 — CID 166385423

IUPAC2-(3,5-dimethoxyphenyl)-3-(2-pyridin-2-ylethoxy)pyridine
SMILESCOc1cc(OC)cc(-c2ncccc2OCCc2ccccn2)c1
InChIInChI=1S/C20H20N2O3/c1-23-17-12-15(13-18(14-17)24-2)20-19(7-5-10-22-20)25-11-8-16-6-3-4-9-21-16/h3-7,9-10,12-14H,8,11H2,1-2H3
InChIKeyKCOZZPCGEROIGB-UHFFFAOYSA-N
MW336.39 g/mol
LogP3.78
Rot. Bonds7

About 2-(3,5-dimethoxyphenyl)-3-(2-pyridin-2-ylethoxy)pyridine

2-(3,5-dimethoxyphenyl)-3-(2-pyridin-2-ylethoxy)pyridine (PubChem CID 166385423) has the molecular formula C20H20N2O3 and a molecular weight of 336.39 g/mol. Its IUPAC name is 2-(3,5-dimethoxyphenyl)-3-(2-pyridin-2-ylethoxy)pyridine.

Molecular Properties

Compound Name2-(3,5-dimethoxyphenyl)-3-(2-pyridin-2-ylethoxy)pyridine
PubChem CID166385423
Molecular FormulaC20H20N2O3
Molecular Weight336.39 g/mol
Exact Mass336.15
IUPAC Name2-(3,5-dimethoxyphenyl)-3-(2-pyridin-2-ylethoxy)pyridine
SMILESCOc1cc(OC)cc(-c2ncccc2OCCc2ccccn2)c1
InChIInChI=1S/C20H20N2O3/c1-23-17-12-15(13-18(14-17)24-2)20-19(7-5-10-22-20)25-11-8-16-6-3-4-9-21-16/h3-7,9-10,12-14H,8,11H2,1-2H3
InChIKeyKCOZZPCGEROIGB-UHFFFAOYSA-N
XLogP3.78
TPSA53.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-methoxy-2-(2-pyridin-2-ylethoxy)benzonitrile
CID 81305629
2-[2-(2-fluorophenoxy)ethyl]pyridine
CID 64765449
2-methoxy-4-(2-pyridin-2-ylethoxy)aniline
CID 63678212
3-[5-methoxy-2-(2-pyridin-2-ylethoxy)phenyl]prop-2-yn-1-ol
CID 104706560
2-methyl-6-(2-pyridin-2-ylethoxy)aniline
CID 60892801
2-[2-(2-nitrophenoxy)ethyl]pyridine
CID 68857749
2-[2-[4-(chloromethyl)-2,6-dimethoxyphenoxy]ethyl]pyridine
CID 60891470
5-methyl-2-(2-pyridin-2-ylethoxy)aniline
CID 22046369
3-(2-phenylethoxy)-2-pyridin-4-ylpyridine
CID 118735185
2-methoxy-N-[[2-(2-pyridin-2-ylethoxy)phenyl]methyl]ethanamine
CID 63058176
2-pyridin-2-ylethyl 2,6-bis[(4,6-dimethoxy-2-pyridinyl)oxy]benzoate
CID 141496169
2-[3-propan-2-yloxy-5-(2-pyridin-2-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine
CID 59243058

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethoxyphenyl)-3-(2-pyridin-2-ylethoxy)pyridine?
The IUPAC name of 2-(3,5-dimethoxyphenyl)-3-(2-pyridin-2-ylethoxy)pyridine (CID 166385423) is 2-(3,5-dimethoxyphenyl)-3-(2-pyridin-2-ylethoxy)pyridine.
What is the SMILES notation for 2-(3,5-dimethoxyphenyl)-3-(2-pyridin-2-ylethoxy)pyridine?
The canonical SMILES for 2-(3,5-dimethoxyphenyl)-3-(2-pyridin-2-ylethoxy)pyridine is COc1cc(OC)cc(-c2ncccc2OCCc2ccccn2)c1.
What is the InChIKey of 2-(3,5-dimethoxyphenyl)-3-(2-pyridin-2-ylethoxy)pyridine?
The InChIKey is KCOZZPCGEROIGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O3/c1-23-17-12-15(13-18(14-17)24-2)20-19(7-5-10-22-20)25-11-8-16-6-3-4-9-21-16/h3-7,9-10,12-14H,8,11H2,1-2H3.
What are the key properties of 2-(3,5-dimethoxyphenyl)-3-(2-pyridin-2-ylethoxy)pyridine?
2-(3,5-dimethoxyphenyl)-3-(2-pyridin-2-ylethoxy)pyridine has a molecular weight of 336.39 g/mol, XLogP of 3.78, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethoxyphenyl)-3-(2-pyridin-2-ylethoxy)pyridine is sourced from PubChem (CID 166385423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).