2-(methoxymethyl)-5-methyl-1H-pyrimidin-6-one

C7H10N2O2 — CID 71351742

IUPAC2-(methoxymethyl)-5-methyl-1H-pyrimidin-6-one
SMILESCOCc1ncc(C)c(=O)[nH]1
InChIInChI=1S/C7H10N2O2/c1-5-3-8-6(4-11-2)9-7(5)10/h3H,4H2,1-2H3,(H,8,9,10)
InChIKeyOHDBUPPRRSOCJZ-UHFFFAOYSA-N
MW154.17 g/mol
LogP0.22
Rot. Bonds2

About 2-(methoxymethyl)-5-methyl-1H-pyrimidin-6-one

2-(methoxymethyl)-5-methyl-1H-pyrimidin-6-one (PubChem CID 71351742) has the molecular formula C7H10N2O2 and a molecular weight of 154.17 g/mol. Its IUPAC name is 2-(methoxymethyl)-5-methyl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-(methoxymethyl)-5-methyl-1H-pyrimidin-6-one
PubChem CID71351742
Molecular FormulaC7H10N2O2
Molecular Weight154.17 g/mol
Exact Mass154.07
IUPAC Name2-(methoxymethyl)-5-methyl-1H-pyrimidin-6-one
SMILESCOCc1ncc(C)c(=O)[nH]1
InChIInChI=1S/C7H10N2O2/c1-5-3-8-6(4-11-2)9-7(5)10/h3H,4H2,1-2H3,(H,8,9,10)
InChIKeyOHDBUPPRRSOCJZ-UHFFFAOYSA-N
XLogP0.22
TPSA54.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-5-methyl-1H-pyrimidin-6-one?
The IUPAC name of 2-(methoxymethyl)-5-methyl-1H-pyrimidin-6-one (CID 71351742) is 2-(methoxymethyl)-5-methyl-1H-pyrimidin-6-one.
What is the SMILES notation for 2-(methoxymethyl)-5-methyl-1H-pyrimidin-6-one?
The canonical SMILES for 2-(methoxymethyl)-5-methyl-1H-pyrimidin-6-one is COCc1ncc(C)c(=O)[nH]1.
What is the InChIKey of 2-(methoxymethyl)-5-methyl-1H-pyrimidin-6-one?
The InChIKey is OHDBUPPRRSOCJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2/c1-5-3-8-6(4-11-2)9-7(5)10/h3H,4H2,1-2H3,(H,8,9,10).
What are the key properties of 2-(methoxymethyl)-5-methyl-1H-pyrimidin-6-one?
2-(methoxymethyl)-5-methyl-1H-pyrimidin-6-one has a molecular weight of 154.17 g/mol, XLogP of 0.22, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-5-methyl-1H-pyrimidin-6-one is sourced from PubChem (CID 71351742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).