4-naphthalen-2-yl-5-pyridin-4-ylpyrimidine

C19H13N3 — CID 54585292

IUPAC4-naphthalen-2-yl-5-pyridin-4-ylpyrimidine
SMILESc1ccc2cc(-c3ncncc3-c3ccncc3)ccc2c1
InChIInChI=1S/C19H13N3/c1-2-4-16-11-17(6-5-14(16)3-1)19-18(12-21-13-22-19)15-7-9-20-10-8-15/h1-13H
InChIKeyFYTQPCAWJIMNQU-UHFFFAOYSA-N
MW283.33 g/mol
LogP4.36
Rot. Bonds2

About 4-naphthalen-2-yl-5-pyridin-4-ylpyrimidine

4-naphthalen-2-yl-5-pyridin-4-ylpyrimidine (PubChem CID 54585292) has the molecular formula C19H13N3 and a molecular weight of 283.33 g/mol. Its IUPAC name is 4-naphthalen-2-yl-5-pyridin-4-ylpyrimidine.

Molecular Properties

Compound Name4-naphthalen-2-yl-5-pyridin-4-ylpyrimidine
PubChem CID54585292
Molecular FormulaC19H13N3
Molecular Weight283.33 g/mol
Exact Mass283.11
IUPAC Name4-naphthalen-2-yl-5-pyridin-4-ylpyrimidine
SMILESc1ccc2cc(-c3ncncc3-c3ccncc3)ccc2c1
InChIInChI=1S/C19H13N3/c1-2-4-16-11-17(6-5-14(16)3-1)19-18(12-21-13-22-19)15-7-9-20-10-8-15/h1-13H
InChIKeyFYTQPCAWJIMNQU-UHFFFAOYSA-N
XLogP4.36
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-naphthalen-2-yl-5-pyridin-4-ylpyrimidine?
The IUPAC name of 4-naphthalen-2-yl-5-pyridin-4-ylpyrimidine (CID 54585292) is 4-naphthalen-2-yl-5-pyridin-4-ylpyrimidine.
What is the SMILES notation for 4-naphthalen-2-yl-5-pyridin-4-ylpyrimidine?
The canonical SMILES for 4-naphthalen-2-yl-5-pyridin-4-ylpyrimidine is c1ccc2cc(-c3ncncc3-c3ccncc3)ccc2c1.
What is the InChIKey of 4-naphthalen-2-yl-5-pyridin-4-ylpyrimidine?
The InChIKey is FYTQPCAWJIMNQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13N3/c1-2-4-16-11-17(6-5-14(16)3-1)19-18(12-21-13-22-19)15-7-9-20-10-8-15/h1-13H.
What are the key properties of 4-naphthalen-2-yl-5-pyridin-4-ylpyrimidine?
4-naphthalen-2-yl-5-pyridin-4-ylpyrimidine has a molecular weight of 283.33 g/mol, XLogP of 4.36, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-naphthalen-2-yl-5-pyridin-4-ylpyrimidine is sourced from PubChem (CID 54585292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).