6-hydroxy-1,3-dimethylpyrimidine-2,4-dione

C6H8N2O3 — CID 11344138

IUPAC6-hydroxy-1,3-dimethylpyrimidine-2,4-dione
SMILESCn1c(O)cc(=O)n(C)c1=O
InChIInChI=1S/C6H8N2O3/c1-7-4(9)3-5(10)8(2)6(7)11/h3,9H,1-2H3
InChIKeyVNZLHJYVIBXTIT-UHFFFAOYSA-N
MW156.14 g/mol
LogP-1.21
Rot. Bonds

About 6-hydroxy-1,3-dimethylpyrimidine-2,4-dione

6-hydroxy-1,3-dimethylpyrimidine-2,4-dione (PubChem CID 11344138) has the molecular formula C6H8N2O3 and a molecular weight of 156.14 g/mol. Its IUPAC name is 6-hydroxy-1,3-dimethylpyrimidine-2,4-dione.

Molecular Properties

Compound Name6-hydroxy-1,3-dimethylpyrimidine-2,4-dione
PubChem CID11344138
Molecular FormulaC6H8N2O3
Molecular Weight156.14 g/mol
Exact Mass156.05
IUPAC Name6-hydroxy-1,3-dimethylpyrimidine-2,4-dione
SMILESCn1c(O)cc(=O)n(C)c1=O
InChIInChI=1S/C6H8N2O3/c1-7-4(9)3-5(10)8(2)6(7)11/h3,9H,1-2H3
InChIKeyVNZLHJYVIBXTIT-UHFFFAOYSA-N
XLogP-1.21
TPSA64.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.14
LogP ≤ 5-1.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-1,3-dimethylpyrimidine-2,4-dione?
The IUPAC name of 6-hydroxy-1,3-dimethylpyrimidine-2,4-dione (CID 11344138) is 6-hydroxy-1,3-dimethylpyrimidine-2,4-dione.
What is the SMILES notation for 6-hydroxy-1,3-dimethylpyrimidine-2,4-dione?
The canonical SMILES for 6-hydroxy-1,3-dimethylpyrimidine-2,4-dione is Cn1c(O)cc(=O)n(C)c1=O.
What is the InChIKey of 6-hydroxy-1,3-dimethylpyrimidine-2,4-dione?
The InChIKey is VNZLHJYVIBXTIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O3/c1-7-4(9)3-5(10)8(2)6(7)11/h3,9H,1-2H3.
What are the key properties of 6-hydroxy-1,3-dimethylpyrimidine-2,4-dione?
6-hydroxy-1,3-dimethylpyrimidine-2,4-dione has a molecular weight of 156.14 g/mol, XLogP of -1.21, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-1,3-dimethylpyrimidine-2,4-dione is sourced from PubChem (CID 11344138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).