2-(3,4-dipyridin-2-ylnaphthalen-2-yl)pyrimidine

C24H16N4 — CID 138982228

IUPAC2-(3,4-dipyridin-2-ylnaphthalen-2-yl)pyrimidine
SMILESc1ccc(-c2c(-c3ncccn3)cc3ccccc3c2-c2ccccn2)nc1
InChIInChI=1S/C24H16N4/c1-2-9-18-17(8-1)16-19(24-27-14-7-15-28-24)23(21-11-4-6-13-26-21)22(18)20-10-3-5-12-25-20/h1-16H
InChIKeyCLWSGZAUSWKRRS-UHFFFAOYSA-N
MW360.42 g/mol
LogP5.42
Rot. Bonds3

About 2-(3,4-dipyridin-2-ylnaphthalen-2-yl)pyrimidine

2-(3,4-dipyridin-2-ylnaphthalen-2-yl)pyrimidine (PubChem CID 138982228) has the molecular formula C24H16N4 and a molecular weight of 360.42 g/mol. Its IUPAC name is 2-(3,4-dipyridin-2-ylnaphthalen-2-yl)pyrimidine.

Molecular Properties

Compound Name2-(3,4-dipyridin-2-ylnaphthalen-2-yl)pyrimidine
PubChem CID138982228
Molecular FormulaC24H16N4
Molecular Weight360.42 g/mol
Exact Mass360.14
IUPAC Name2-(3,4-dipyridin-2-ylnaphthalen-2-yl)pyrimidine
SMILESc1ccc(-c2c(-c3ncccn3)cc3ccccc3c2-c2ccccn2)nc1
InChIInChI=1S/C24H16N4/c1-2-9-18-17(8-1)16-19(24-27-14-7-15-28-24)23(21-11-4-6-13-26-21)22(18)20-10-3-5-12-25-20/h1-16H
InChIKeyCLWSGZAUSWKRRS-UHFFFAOYSA-N
XLogP5.42
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.42
LogP ≤ 55.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-hydroxy-3-(6-pyridin-2-yl-2-pyridinyl)naphthalen-1-yl]-3-(6-pyridin-2-yl-2-pyridinyl)naphthalen-2-ol
CID 177474104
2,4,6-tris(2,3,4,5-tetrapyridin-2-ylphenyl)-1,3,5-triazine
CID 23597794
2-benzo[a]anthracen-7-ylpyridine
CID 154825161
2-(4-anthracen-9-ylphenyl)-4,6-dipyridin-2-yl-1,3,5-triazine
CID 102088203
2-(1-pyridin-2-ylanthracen-2-yl)pyridine
CID 19367617
2-anthracen-9-yl-9-pyridin-2-yl-1,10-phenanthroline
CID 171732364
4-[2-(2-phenanthren-9-ylphenyl)phenyl]-2,6-dipyridin-2-ylpyridine
CID 166685007
2-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]pyridine
CID 118487428
2-[6-phenyl-8-(6-pyridin-2-yl-2-pyridinyl)benzo[a]tetracen-13-yl]-6-pyridin-2-ylpyridine
CID 89177926
2-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]pyridine
CID 118487396
4-(6-phenanthren-9-ylnaphthalen-2-yl)-2,6-dipyridin-2-ylpyridine
CID 166685120
2,4,6-tripyridin-2-ylpyrimidine
CID 70005539

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dipyridin-2-ylnaphthalen-2-yl)pyrimidine?
The IUPAC name of 2-(3,4-dipyridin-2-ylnaphthalen-2-yl)pyrimidine (CID 138982228) is 2-(3,4-dipyridin-2-ylnaphthalen-2-yl)pyrimidine.
What is the SMILES notation for 2-(3,4-dipyridin-2-ylnaphthalen-2-yl)pyrimidine?
The canonical SMILES for 2-(3,4-dipyridin-2-ylnaphthalen-2-yl)pyrimidine is c1ccc(-c2c(-c3ncccn3)cc3ccccc3c2-c2ccccn2)nc1.
What is the InChIKey of 2-(3,4-dipyridin-2-ylnaphthalen-2-yl)pyrimidine?
The InChIKey is CLWSGZAUSWKRRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16N4/c1-2-9-18-17(8-1)16-19(24-27-14-7-15-28-24)23(21-11-4-6-13-26-21)22(18)20-10-3-5-12-25-20/h1-16H.
What are the key properties of 2-(3,4-dipyridin-2-ylnaphthalen-2-yl)pyrimidine?
2-(3,4-dipyridin-2-ylnaphthalen-2-yl)pyrimidine has a molecular weight of 360.42 g/mol, XLogP of 5.42, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dipyridin-2-ylnaphthalen-2-yl)pyrimidine is sourced from PubChem (CID 138982228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).