1-pyrimidin-2-ylimidazolidin-2-one

C7H8N4O — CID 14834333

IUPAC1-pyrimidin-2-ylimidazolidin-2-one
SMILESO=C1NCCN1c1ncccn1
InChIInChI=1S/C7H8N4O/c12-7-10-4-5-11(7)6-8-2-1-3-9-6/h1-3H,4-5H2,(H,10,12)
InChIKeyJQNKNJCSTPSZRP-UHFFFAOYSA-N
MW164.17 g/mol
LogP0.01
Rot. Bonds1

About 1-pyrimidin-2-ylimidazolidin-2-one

1-pyrimidin-2-ylimidazolidin-2-one (PubChem CID 14834333) has the molecular formula C7H8N4O and a molecular weight of 164.17 g/mol. Its IUPAC name is 1-pyrimidin-2-ylimidazolidin-2-one.

Molecular Properties

Compound Name1-pyrimidin-2-ylimidazolidin-2-one
PubChem CID14834333
Molecular FormulaC7H8N4O
Molecular Weight164.17 g/mol
Exact Mass164.07
IUPAC Name1-pyrimidin-2-ylimidazolidin-2-one
SMILESO=C1NCCN1c1ncccn1
InChIInChI=1S/C7H8N4O/c12-7-10-4-5-11(7)6-8-2-1-3-9-6/h1-3H,4-5H2,(H,10,12)
InChIKeyJQNKNJCSTPSZRP-UHFFFAOYSA-N
XLogP0.01
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.17
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-pyrimidin-2-ylimidazolidin-2-one?
The IUPAC name of 1-pyrimidin-2-ylimidazolidin-2-one (CID 14834333) is 1-pyrimidin-2-ylimidazolidin-2-one.
What is the SMILES notation for 1-pyrimidin-2-ylimidazolidin-2-one?
The canonical SMILES for 1-pyrimidin-2-ylimidazolidin-2-one is O=C1NCCN1c1ncccn1.
What is the InChIKey of 1-pyrimidin-2-ylimidazolidin-2-one?
The InChIKey is JQNKNJCSTPSZRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N4O/c12-7-10-4-5-11(7)6-8-2-1-3-9-6/h1-3H,4-5H2,(H,10,12).
What are the key properties of 1-pyrimidin-2-ylimidazolidin-2-one?
1-pyrimidin-2-ylimidazolidin-2-one has a molecular weight of 164.17 g/mol, XLogP of 0.01, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyrimidin-2-ylimidazolidin-2-one is sourced from PubChem (CID 14834333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).