6-hydroxy-5-methyl-1H-pyrimidine-2,4-dione

C5H6N2O3 — CID 676413

IUPAC6-hydroxy-5-methyl-1H-pyrimidine-2,4-dione
SMILESCc1c(O)[nH]c(=O)[nH]c1=O
InChIInChI=1S/C5H6N2O3/c1-2-3(8)6-5(10)7-4(2)9/h1H3,(H3,6,7,8,9,10)
InChIKeyINCRRYKLCCVPJD-UHFFFAOYSA-N
MW142.11 g/mol
LogP-0.92
Rot. Bonds

About 6-hydroxy-5-methyl-1H-pyrimidine-2,4-dione

6-hydroxy-5-methyl-1H-pyrimidine-2,4-dione (PubChem CID 676413) has the molecular formula C5H6N2O3 and a molecular weight of 142.11 g/mol. Its IUPAC name is 6-hydroxy-5-methyl-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-hydroxy-5-methyl-1H-pyrimidine-2,4-dione
PubChem CID676413
Molecular FormulaC5H6N2O3
Molecular Weight142.11 g/mol
Exact Mass142.04
IUPAC Name6-hydroxy-5-methyl-1H-pyrimidine-2,4-dione
SMILESCc1c(O)[nH]c(=O)[nH]c1=O
InChIInChI=1S/C5H6N2O3/c1-2-3(8)6-5(10)7-4(2)9/h1H3,(H3,6,7,8,9,10)
InChIKeyINCRRYKLCCVPJD-UHFFFAOYSA-N
XLogP-0.92
TPSA85.95 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.11
LogP ≤ 5-0.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-5-methyl-1H-pyrimidine-2,4-dione?
The IUPAC name of 6-hydroxy-5-methyl-1H-pyrimidine-2,4-dione (CID 676413) is 6-hydroxy-5-methyl-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 6-hydroxy-5-methyl-1H-pyrimidine-2,4-dione?
The canonical SMILES for 6-hydroxy-5-methyl-1H-pyrimidine-2,4-dione is Cc1c(O)[nH]c(=O)[nH]c1=O.
What is the InChIKey of 6-hydroxy-5-methyl-1H-pyrimidine-2,4-dione?
The InChIKey is INCRRYKLCCVPJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2O3/c1-2-3(8)6-5(10)7-4(2)9/h1H3,(H3,6,7,8,9,10).
What are the key properties of 6-hydroxy-5-methyl-1H-pyrimidine-2,4-dione?
6-hydroxy-5-methyl-1H-pyrimidine-2,4-dione has a molecular weight of 142.11 g/mol, XLogP of -0.92, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-5-methyl-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 676413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).