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

C11H10N2O2 — CID 24974482

IUPAC5-methyl-6-phenyl-1H-pyrimidine-2,4-dione
SMILESCc1c(-c2ccccc2)[nH]c(=O)[nH]c1=O
InChIInChI=1S/C11H10N2O2/c1-7-9(8-5-3-2-4-6-8)12-11(15)13-10(7)14/h2-6H,1H3,(H2,12,13,14,15)
InChIKeyRZDTYDUYAOWRMY-UHFFFAOYSA-N
MW202.21 g/mol
LogP1.04
Rot. Bonds1

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

5-methyl-6-phenyl-1H-pyrimidine-2,4-dione (PubChem CID 24974482) has the molecular formula C11H10N2O2 and a molecular weight of 202.21 g/mol. Its IUPAC name is 5-methyl-6-phenyl-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-methyl-6-phenyl-1H-pyrimidine-2,4-dione
PubChem CID24974482
Molecular FormulaC11H10N2O2
Molecular Weight202.21 g/mol
Exact Mass202.07
IUPAC Name5-methyl-6-phenyl-1H-pyrimidine-2,4-dione
SMILESCc1c(-c2ccccc2)[nH]c(=O)[nH]c1=O
InChIInChI=1S/C11H10N2O2/c1-7-9(8-5-3-2-4-6-8)12-11(15)13-10(7)14/h2-6H,1H3,(H2,12,13,14,15)
InChIKeyRZDTYDUYAOWRMY-UHFFFAOYSA-N
XLogP1.04
TPSA65.72 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-6-phenyl-1H-pyrimidine-2,4-dione?
The IUPAC name of 5-methyl-6-phenyl-1H-pyrimidine-2,4-dione (CID 24974482) is 5-methyl-6-phenyl-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 5-methyl-6-phenyl-1H-pyrimidine-2,4-dione?
The canonical SMILES for 5-methyl-6-phenyl-1H-pyrimidine-2,4-dione is Cc1c(-c2ccccc2)[nH]c(=O)[nH]c1=O.
What is the InChIKey of 5-methyl-6-phenyl-1H-pyrimidine-2,4-dione?
The InChIKey is RZDTYDUYAOWRMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2/c1-7-9(8-5-3-2-4-6-8)12-11(15)13-10(7)14/h2-6H,1H3,(H2,12,13,14,15).
What are the key properties of 5-methyl-6-phenyl-1H-pyrimidine-2,4-dione?
5-methyl-6-phenyl-1H-pyrimidine-2,4-dione has a molecular weight of 202.21 g/mol, XLogP of 1.04, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-6-phenyl-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 24974482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).