2-naphthalen-1-yl-4-naphthalen-2-ylpyridine

C25H17N — CID 144888160

IUPAC2-naphthalen-1-yl-4-naphthalen-2-ylpyridine
SMILESc1ccc2cc(-c3ccnc(-c4cccc5ccccc45)c3)ccc2c1
InChIInChI=1S/C25H17N/c1-2-8-20-16-21(13-12-18(20)6-1)22-14-15-26-25(17-22)24-11-5-9-19-7-3-4-10-23(19)24/h1-17H
InChIKeyQLCHVSBBSQIASX-UHFFFAOYSA-N
MW331.42 g/mol
LogP6.72
Rot. Bonds2

About 2-naphthalen-1-yl-4-naphthalen-2-ylpyridine

2-naphthalen-1-yl-4-naphthalen-2-ylpyridine (PubChem CID 144888160) has the molecular formula C25H17N and a molecular weight of 331.42 g/mol. Its IUPAC name is 2-naphthalen-1-yl-4-naphthalen-2-ylpyridine.

Molecular Properties

Compound Name2-naphthalen-1-yl-4-naphthalen-2-ylpyridine
PubChem CID144888160
Molecular FormulaC25H17N
Molecular Weight331.42 g/mol
Exact Mass331.14
IUPAC Name2-naphthalen-1-yl-4-naphthalen-2-ylpyridine
SMILESc1ccc2cc(-c3ccnc(-c4cccc5ccccc45)c3)ccc2c1
InChIInChI=1S/C25H17N/c1-2-8-20-16-21(13-12-18(20)6-1)22-14-15-26-25(17-22)24-11-5-9-19-7-3-4-10-23(19)24/h1-17H
InChIKeyQLCHVSBBSQIASX-UHFFFAOYSA-N
XLogP6.72
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500331.42
LogP ≤ 56.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yl-4-naphthalen-2-ylpyridine?
The IUPAC name of 2-naphthalen-1-yl-4-naphthalen-2-ylpyridine (CID 144888160) is 2-naphthalen-1-yl-4-naphthalen-2-ylpyridine.
What is the SMILES notation for 2-naphthalen-1-yl-4-naphthalen-2-ylpyridine?
The canonical SMILES for 2-naphthalen-1-yl-4-naphthalen-2-ylpyridine is c1ccc2cc(-c3ccnc(-c4cccc5ccccc45)c3)ccc2c1.
What is the InChIKey of 2-naphthalen-1-yl-4-naphthalen-2-ylpyridine?
The InChIKey is QLCHVSBBSQIASX-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H17N/c1-2-8-20-16-21(13-12-18(20)6-1)22-14-15-26-25(17-22)24-11-5-9-19-7-3-4-10-23(19)24/h1-17H.
What are the key properties of 2-naphthalen-1-yl-4-naphthalen-2-ylpyridine?
2-naphthalen-1-yl-4-naphthalen-2-ylpyridine has a molecular weight of 331.42 g/mol, XLogP of 6.72, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yl-4-naphthalen-2-ylpyridine is sourced from PubChem (CID 144888160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).