6-hydroxy-5-methyl-1-naphthalen-2-ylpyrimidine-2,4-dione

C15H12N2O3 — CID 115947092

IUPAC6-hydroxy-5-methyl-1-naphthalen-2-ylpyrimidine-2,4-dione
SMILESCc1c(O)n(-c2ccc3ccccc3c2)c(=O)[nH]c1=O
InChIInChI=1S/C15H12N2O3/c1-9-13(18)16-15(20)17(14(9)19)12-7-6-10-4-2-3-5-11(10)8-12/h2-8,19H,1H3,(H,16,18,20)
InChIKeyUGEHWBLKLGQYQE-UHFFFAOYSA-N
MW268.27 g/mol
LogP1.69
Rot. Bonds1

About 6-hydroxy-5-methyl-1-naphthalen-2-ylpyrimidine-2,4-dione

6-hydroxy-5-methyl-1-naphthalen-2-ylpyrimidine-2,4-dione (PubChem CID 115947092) has the molecular formula C15H12N2O3 and a molecular weight of 268.27 g/mol. Its IUPAC name is 6-hydroxy-5-methyl-1-naphthalen-2-ylpyrimidine-2,4-dione.

Molecular Properties

Compound Name6-hydroxy-5-methyl-1-naphthalen-2-ylpyrimidine-2,4-dione
PubChem CID115947092
Molecular FormulaC15H12N2O3
Molecular Weight268.27 g/mol
Exact Mass268.08
IUPAC Name6-hydroxy-5-methyl-1-naphthalen-2-ylpyrimidine-2,4-dione
SMILESCc1c(O)n(-c2ccc3ccccc3c2)c(=O)[nH]c1=O
InChIInChI=1S/C15H12N2O3/c1-9-13(18)16-15(20)17(14(9)19)12-7-6-10-4-2-3-5-11(10)8-12/h2-8,19H,1H3,(H,16,18,20)
InChIKeyUGEHWBLKLGQYQE-UHFFFAOYSA-N
XLogP1.69
TPSA75.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.27
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-5-methyl-1-naphthalen-2-ylpyrimidine-2,4-dione?
The IUPAC name of 6-hydroxy-5-methyl-1-naphthalen-2-ylpyrimidine-2,4-dione (CID 115947092) is 6-hydroxy-5-methyl-1-naphthalen-2-ylpyrimidine-2,4-dione.
What is the SMILES notation for 6-hydroxy-5-methyl-1-naphthalen-2-ylpyrimidine-2,4-dione?
The canonical SMILES for 6-hydroxy-5-methyl-1-naphthalen-2-ylpyrimidine-2,4-dione is Cc1c(O)n(-c2ccc3ccccc3c2)c(=O)[nH]c1=O.
What is the InChIKey of 6-hydroxy-5-methyl-1-naphthalen-2-ylpyrimidine-2,4-dione?
The InChIKey is UGEHWBLKLGQYQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O3/c1-9-13(18)16-15(20)17(14(9)19)12-7-6-10-4-2-3-5-11(10)8-12/h2-8,19H,1H3,(H,16,18,20).
What are the key properties of 6-hydroxy-5-methyl-1-naphthalen-2-ylpyrimidine-2,4-dione?
6-hydroxy-5-methyl-1-naphthalen-2-ylpyrimidine-2,4-dione has a molecular weight of 268.27 g/mol, XLogP of 1.69, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-5-methyl-1-naphthalen-2-ylpyrimidine-2,4-dione is sourced from PubChem (CID 115947092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).