3-(2,6-dimethoxy-4-pyridin-3-ylnaphthalen-1-yl)pyridine

C22H18N2O2 — CID 169050278

IUPAC3-(2,6-dimethoxy-4-pyridin-3-ylnaphthalen-1-yl)pyridine
SMILESCOc1ccc2c(-c3cccnc3)c(OC)cc(-c3cccnc3)c2c1
InChIInChI=1S/C22H18N2O2/c1-25-17-7-8-18-20(11-17)19(15-5-3-9-23-13-15)12-21(26-2)22(18)16-6-4-10-24-14-16/h3-14H,1-2H3
InChIKeyLCBVEZMRMFAPDK-UHFFFAOYSA-N
MW342.40 g/mol
LogP4.98
Rot. Bonds4

About 3-(2,6-dimethoxy-4-pyridin-3-ylnaphthalen-1-yl)pyridine

3-(2,6-dimethoxy-4-pyridin-3-ylnaphthalen-1-yl)pyridine (PubChem CID 169050278) has the molecular formula C22H18N2O2 and a molecular weight of 342.40 g/mol. Its IUPAC name is 3-(2,6-dimethoxy-4-pyridin-3-ylnaphthalen-1-yl)pyridine.

Molecular Properties

Compound Name3-(2,6-dimethoxy-4-pyridin-3-ylnaphthalen-1-yl)pyridine
PubChem CID169050278
Molecular FormulaC22H18N2O2
Molecular Weight342.40 g/mol
Exact Mass342.14
IUPAC Name3-(2,6-dimethoxy-4-pyridin-3-ylnaphthalen-1-yl)pyridine
SMILESCOc1ccc2c(-c3cccnc3)c(OC)cc(-c3cccnc3)c2c1
InChIInChI=1S/C22H18N2O2/c1-25-17-7-8-18-20(11-17)19(15-5-3-9-23-13-15)12-21(26-2)22(18)16-6-4-10-24-14-16/h3-14H,1-2H3
InChIKeyLCBVEZMRMFAPDK-UHFFFAOYSA-N
XLogP4.98
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2,4-dimethoxyphenyl)pyridine
CID 46316965
3-(2,5-dimethoxy-4-pyridin-3-ylphenyl)pyridine
CID 156631933
4-methoxy-2-pyridin-3-ylaniline
CID 71445761
2-(2,6-dimethoxy-4-pyridin-2-ylnaphthalen-1-yl)pyridine
CID 169050230
3-(2-methoxyphenyl)pyridine
CID 4133297
3-(2,3-dimethoxyphenyl)pyridine
CID 22001178
3-(3,4,5-trimethoxyphenyl)pyridine
CID 141070241
3-(2-methoxy-3-pyridin-3-ylphenyl)pyridine
CID 46316374
3,4-dimethoxy-5-pyridin-3-ylbenzonitrile
CID 39231339
2-(3,4-dimethoxy-5-pyridin-3-ylphenyl)ethanamine
CID 39226574
2-chloro-4-methoxy-5-pyridin-3-ylpyridine
CID 175166261
3-(2-cyanoethyl)-6-methoxy-4-pyridin-3-ylisoquinoline-1-carboxamide
CID 91276860

Frequently Asked Questions

What is the IUPAC name of 3-(2,6-dimethoxy-4-pyridin-3-ylnaphthalen-1-yl)pyridine?
The IUPAC name of 3-(2,6-dimethoxy-4-pyridin-3-ylnaphthalen-1-yl)pyridine (CID 169050278) is 3-(2,6-dimethoxy-4-pyridin-3-ylnaphthalen-1-yl)pyridine.
What is the SMILES notation for 3-(2,6-dimethoxy-4-pyridin-3-ylnaphthalen-1-yl)pyridine?
The canonical SMILES for 3-(2,6-dimethoxy-4-pyridin-3-ylnaphthalen-1-yl)pyridine is COc1ccc2c(-c3cccnc3)c(OC)cc(-c3cccnc3)c2c1.
What is the InChIKey of 3-(2,6-dimethoxy-4-pyridin-3-ylnaphthalen-1-yl)pyridine?
The InChIKey is LCBVEZMRMFAPDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O2/c1-25-17-7-8-18-20(11-17)19(15-5-3-9-23-13-15)12-21(26-2)22(18)16-6-4-10-24-14-16/h3-14H,1-2H3.
What are the key properties of 3-(2,6-dimethoxy-4-pyridin-3-ylnaphthalen-1-yl)pyridine?
3-(2,6-dimethoxy-4-pyridin-3-ylnaphthalen-1-yl)pyridine has a molecular weight of 342.40 g/mol, XLogP of 4.98, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,6-dimethoxy-4-pyridin-3-ylnaphthalen-1-yl)pyridine is sourced from PubChem (CID 169050278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).