2-(6-methoxypyrimidin-4-yl)-4-methyl-1,4-dihydroimidazol-5-one

C9H10N4O2 — CID 106952069

IUPAC2-(6-methoxypyrimidin-4-yl)-4-methyl-1,4-dihydroimidazol-5-one
SMILESCOc1cc(C2=NC(C)C(=O)N2)ncn1
InChIInChI=1S/C9H10N4O2/c1-5-9(14)13-8(12-5)6-3-7(15-2)11-4-10-6/h3-5H,1-2H3,(H,12,13,14)
InChIKeyGGAHMMYPOFVENU-UHFFFAOYSA-N
MW206.20 g/mol
LogP-0.25
Rot. Bonds2

About 2-(6-methoxypyrimidin-4-yl)-4-methyl-1,4-dihydroimidazol-5-one

2-(6-methoxypyrimidin-4-yl)-4-methyl-1,4-dihydroimidazol-5-one (PubChem CID 106952069) has the molecular formula C9H10N4O2 and a molecular weight of 206.20 g/mol. Its IUPAC name is 2-(6-methoxypyrimidin-4-yl)-4-methyl-1,4-dihydroimidazol-5-one.

Molecular Properties

Compound Name2-(6-methoxypyrimidin-4-yl)-4-methyl-1,4-dihydroimidazol-5-one
PubChem CID106952069
Molecular FormulaC9H10N4O2
Molecular Weight206.20 g/mol
Exact Mass206.08
IUPAC Name2-(6-methoxypyrimidin-4-yl)-4-methyl-1,4-dihydroimidazol-5-one
SMILESCOc1cc(C2=NC(C)C(=O)N2)ncn1
InChIInChI=1S/C9H10N4O2/c1-5-9(14)13-8(12-5)6-3-7(15-2)11-4-10-6/h3-5H,1-2H3,(H,12,13,14)
InChIKeyGGAHMMYPOFVENU-UHFFFAOYSA-N
XLogP-0.25
TPSA76.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.20
LogP ≤ 5-0.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(6-methoxypyrimidin-4-yl)-4-methyl-1,4-dihydroimidazol-5-one?
The IUPAC name of 2-(6-methoxypyrimidin-4-yl)-4-methyl-1,4-dihydroimidazol-5-one (CID 106952069) is 2-(6-methoxypyrimidin-4-yl)-4-methyl-1,4-dihydroimidazol-5-one.
What is the SMILES notation for 2-(6-methoxypyrimidin-4-yl)-4-methyl-1,4-dihydroimidazol-5-one?
The canonical SMILES for 2-(6-methoxypyrimidin-4-yl)-4-methyl-1,4-dihydroimidazol-5-one is COc1cc(C2=NC(C)C(=O)N2)ncn1.
What is the InChIKey of 2-(6-methoxypyrimidin-4-yl)-4-methyl-1,4-dihydroimidazol-5-one?
The InChIKey is GGAHMMYPOFVENU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O2/c1-5-9(14)13-8(12-5)6-3-7(15-2)11-4-10-6/h3-5H,1-2H3,(H,12,13,14).
What are the key properties of 2-(6-methoxypyrimidin-4-yl)-4-methyl-1,4-dihydroimidazol-5-one?
2-(6-methoxypyrimidin-4-yl)-4-methyl-1,4-dihydroimidazol-5-one has a molecular weight of 206.20 g/mol, XLogP of -0.25, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxypyrimidin-4-yl)-4-methyl-1,4-dihydroimidazol-5-one is sourced from PubChem (CID 106952069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).