4-naphthalen-1-yl-1,6-naphthyridine

C18H12N2 — CID 166273330

IUPAC4-naphthalen-1-yl-1,6-naphthyridine
SMILESc1ccc2c(-c3ccnc4ccncc34)cccc2c1
InChIInChI=1S/C18H12N2/c1-2-6-14-13(4-1)5-3-7-15(14)16-8-11-20-18-9-10-19-12-17(16)18/h1-12H
InChIKeyWPDLWMBXODRYPG-UHFFFAOYSA-N
MW256.31 g/mol
LogP4.45
Rot. Bonds1

About 4-naphthalen-1-yl-1,6-naphthyridine

4-naphthalen-1-yl-1,6-naphthyridine (PubChem CID 166273330) has the molecular formula C18H12N2 and a molecular weight of 256.31 g/mol. Its IUPAC name is 4-naphthalen-1-yl-1,6-naphthyridine.

Molecular Properties

Compound Name4-naphthalen-1-yl-1,6-naphthyridine
PubChem CID166273330
Molecular FormulaC18H12N2
Molecular Weight256.31 g/mol
Exact Mass256.10
IUPAC Name4-naphthalen-1-yl-1,6-naphthyridine
SMILESc1ccc2c(-c3ccnc4ccncc34)cccc2c1
InChIInChI=1S/C18H12N2/c1-2-6-14-13(4-1)5-3-7-15(14)16-8-11-20-18-9-10-19-12-17(16)18/h1-12H
InChIKeyWPDLWMBXODRYPG-UHFFFAOYSA-N
XLogP4.45
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-naphthalen-1-yl-1,6-naphthyridine?
The IUPAC name of 4-naphthalen-1-yl-1,6-naphthyridine (CID 166273330) is 4-naphthalen-1-yl-1,6-naphthyridine.
What is the SMILES notation for 4-naphthalen-1-yl-1,6-naphthyridine?
The canonical SMILES for 4-naphthalen-1-yl-1,6-naphthyridine is c1ccc2c(-c3ccnc4ccncc34)cccc2c1.
What is the InChIKey of 4-naphthalen-1-yl-1,6-naphthyridine?
The InChIKey is WPDLWMBXODRYPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12N2/c1-2-6-14-13(4-1)5-3-7-15(14)16-8-11-20-18-9-10-19-12-17(16)18/h1-12H.
What are the key properties of 4-naphthalen-1-yl-1,6-naphthyridine?
4-naphthalen-1-yl-1,6-naphthyridine has a molecular weight of 256.31 g/mol, XLogP of 4.45, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-naphthalen-1-yl-1,6-naphthyridine is sourced from PubChem (CID 166273330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).