3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine

C20H14N2 — CID 169050404

IUPAC3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine
SMILESc1cncc(-c2cccc3c(-c4cccnc4)cccc23)c1
InChIInChI=1S/C20H14N2/c1-7-17(15-5-3-11-21-13-15)20-10-2-8-18(19(20)9-1)16-6-4-12-22-14-16/h1-14H
InChIKeyHVSIGQCINIMCIF-UHFFFAOYSA-N
MW282.35 g/mol
LogP4.96
Rot. Bonds2

About 3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine

3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine (PubChem CID 169050404) has the molecular formula C20H14N2 and a molecular weight of 282.35 g/mol. Its IUPAC name is 3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine.

Molecular Properties

Compound Name3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine
PubChem CID169050404
Molecular FormulaC20H14N2
Molecular Weight282.35 g/mol
Exact Mass282.12
IUPAC Name3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine
SMILESc1cncc(-c2cccc3c(-c4cccnc4)cccc23)c1
InChIInChI=1S/C20H14N2/c1-7-17(15-5-3-11-21-13-15)20-10-2-8-18(19(20)9-1)16-6-4-12-22-14-16/h1-14H
InChIKeyHVSIGQCINIMCIF-UHFFFAOYSA-N
XLogP4.96
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine?
The IUPAC name of 3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine (CID 169050404) is 3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine.
What is the SMILES notation for 3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine?
The canonical SMILES for 3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine is c1cncc(-c2cccc3c(-c4cccnc4)cccc23)c1.
What is the InChIKey of 3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine?
The InChIKey is HVSIGQCINIMCIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N2/c1-7-17(15-5-3-11-21-13-15)20-10-2-8-18(19(20)9-1)16-6-4-12-22-14-16/h1-14H.
What are the key properties of 3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine?
3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine has a molecular weight of 282.35 g/mol, XLogP of 4.96, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine is sourced from PubChem (CID 169050404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).