1-methyl-2,3,5,6-tetrahydroimidazo[1,2-a]pyrimidin-7-one

C7H11N3O — CID 13492725

IUPAC1-methyl-2,3,5,6-tetrahydroimidazo[1,2-a]pyrimidin-7-one
SMILESCN1CCN2CCC(=O)N=C12
InChIInChI=1S/C7H11N3O/c1-9-4-5-10-3-2-6(11)8-7(9)10/h2-5H2,1H3
InChIKeyUBTYTAKNARFOEH-UHFFFAOYSA-N
MW153.19 g/mol
LogP-0.48
Rot. Bonds

About 1-methyl-2,3,5,6-tetrahydroimidazo[1,2-a]pyrimidin-7-one

1-methyl-2,3,5,6-tetrahydroimidazo[1,2-a]pyrimidin-7-one (PubChem CID 13492725) has the molecular formula C7H11N3O and a molecular weight of 153.19 g/mol. Its IUPAC name is 1-methyl-2,3,5,6-tetrahydroimidazo[1,2-a]pyrimidin-7-one.

Molecular Properties

Compound Name1-methyl-2,3,5,6-tetrahydroimidazo[1,2-a]pyrimidin-7-one
PubChem CID13492725
Molecular FormulaC7H11N3O
Molecular Weight153.19 g/mol
Exact Mass153.09
IUPAC Name1-methyl-2,3,5,6-tetrahydroimidazo[1,2-a]pyrimidin-7-one
SMILESCN1CCN2CCC(=O)N=C12
InChIInChI=1S/C7H11N3O/c1-9-4-5-10-3-2-6(11)8-7(9)10/h2-5H2,1H3
InChIKeyUBTYTAKNARFOEH-UHFFFAOYSA-N
XLogP-0.48
TPSA35.91 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.19
LogP ≤ 5-0.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2,3,5,6-tetrahydroimidazo[1,2-a]pyrimidin-7-one?
The IUPAC name of 1-methyl-2,3,5,6-tetrahydroimidazo[1,2-a]pyrimidin-7-one (CID 13492725) is 1-methyl-2,3,5,6-tetrahydroimidazo[1,2-a]pyrimidin-7-one.
What is the SMILES notation for 1-methyl-2,3,5,6-tetrahydroimidazo[1,2-a]pyrimidin-7-one?
The canonical SMILES for 1-methyl-2,3,5,6-tetrahydroimidazo[1,2-a]pyrimidin-7-one is CN1CCN2CCC(=O)N=C12.
What is the InChIKey of 1-methyl-2,3,5,6-tetrahydroimidazo[1,2-a]pyrimidin-7-one?
The InChIKey is UBTYTAKNARFOEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-9-4-5-10-3-2-6(11)8-7(9)10/h2-5H2,1H3.
What are the key properties of 1-methyl-2,3,5,6-tetrahydroimidazo[1,2-a]pyrimidin-7-one?
1-methyl-2,3,5,6-tetrahydroimidazo[1,2-a]pyrimidin-7-one has a molecular weight of 153.19 g/mol, XLogP of -0.48, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2,3,5,6-tetrahydroimidazo[1,2-a]pyrimidin-7-one is sourced from PubChem (CID 13492725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).