6,8-dimethyl-3-(2-oxopropyl)imidazo[1,2-c]pyrimidin-5-one

C11H13N3O2 — CID 71064826

IUPAC6,8-dimethyl-3-(2-oxopropyl)imidazo[1,2-c]pyrimidin-5-one
SMILESCC(=O)Cc1cnc2c(C)cn(C)c(=O)n12
InChIInChI=1S/C11H13N3O2/c1-7-6-13(3)11(16)14-9(4-8(2)15)5-12-10(7)14/h5-6H,4H2,1-3H3
InChIKeyVOOHOLNFUKTQSJ-UHFFFAOYSA-N
MW219.24 g/mol
LogP0.47
Rot. Bonds2

About 6,8-dimethyl-3-(2-oxopropyl)imidazo[1,2-c]pyrimidin-5-one

6,8-dimethyl-3-(2-oxopropyl)imidazo[1,2-c]pyrimidin-5-one (PubChem CID 71064826) has the molecular formula C11H13N3O2 and a molecular weight of 219.24 g/mol. Its IUPAC name is 6,8-dimethyl-3-(2-oxopropyl)imidazo[1,2-c]pyrimidin-5-one.

Molecular Properties

Compound Name6,8-dimethyl-3-(2-oxopropyl)imidazo[1,2-c]pyrimidin-5-one
PubChem CID71064826
Molecular FormulaC11H13N3O2
Molecular Weight219.24 g/mol
Exact Mass219.10
IUPAC Name6,8-dimethyl-3-(2-oxopropyl)imidazo[1,2-c]pyrimidin-5-one
SMILESCC(=O)Cc1cnc2c(C)cn(C)c(=O)n12
InChIInChI=1S/C11H13N3O2/c1-7-6-13(3)11(16)14-9(4-8(2)15)5-12-10(7)14/h5-6H,4H2,1-3H3
InChIKeyVOOHOLNFUKTQSJ-UHFFFAOYSA-N
XLogP0.47
TPSA56.37 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.24
LogP ≤ 50.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6,8-dimethyl-3-(2-oxopropyl)imidazo[1,2-c]pyrimidin-5-one?
The IUPAC name of 6,8-dimethyl-3-(2-oxopropyl)imidazo[1,2-c]pyrimidin-5-one (CID 71064826) is 6,8-dimethyl-3-(2-oxopropyl)imidazo[1,2-c]pyrimidin-5-one.
What is the SMILES notation for 6,8-dimethyl-3-(2-oxopropyl)imidazo[1,2-c]pyrimidin-5-one?
The canonical SMILES for 6,8-dimethyl-3-(2-oxopropyl)imidazo[1,2-c]pyrimidin-5-one is CC(=O)Cc1cnc2c(C)cn(C)c(=O)n12.
What is the InChIKey of 6,8-dimethyl-3-(2-oxopropyl)imidazo[1,2-c]pyrimidin-5-one?
The InChIKey is VOOHOLNFUKTQSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O2/c1-7-6-13(3)11(16)14-9(4-8(2)15)5-12-10(7)14/h5-6H,4H2,1-3H3.
What are the key properties of 6,8-dimethyl-3-(2-oxopropyl)imidazo[1,2-c]pyrimidin-5-one?
6,8-dimethyl-3-(2-oxopropyl)imidazo[1,2-c]pyrimidin-5-one has a molecular weight of 219.24 g/mol, XLogP of 0.47, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dimethyl-3-(2-oxopropyl)imidazo[1,2-c]pyrimidin-5-one is sourced from PubChem (CID 71064826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).