6,7-dimethyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one

C8H11N3O — CID 135581429

IUPAC6,7-dimethyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one
SMILESCc1nc2n(c(=O)c1C)CCN2
InChIInChI=1S/C8H11N3O/c1-5-6(2)10-8-9-3-4-11(8)7(5)12/h3-4H2,1-2H3,(H,9,10)
InChIKeyNGNOEROYVOIDIH-UHFFFAOYSA-N
MW165.20 g/mol
LogP0.29
Rot. Bonds

About 6,7-dimethyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one

6,7-dimethyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one (PubChem CID 135581429) has the molecular formula C8H11N3O and a molecular weight of 165.20 g/mol. Its IUPAC name is 6,7-dimethyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one.

Molecular Properties

Compound Name6,7-dimethyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one
PubChem CID135581429
Molecular FormulaC8H11N3O
Molecular Weight165.20 g/mol
Exact Mass165.09
IUPAC Name6,7-dimethyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one
SMILESCc1nc2n(c(=O)c1C)CCN2
InChIInChI=1S/C8H11N3O/c1-5-6(2)10-8-9-3-4-11(8)7(5)12/h3-4H2,1-2H3,(H,9,10)
InChIKeyNGNOEROYVOIDIH-UHFFFAOYSA-N
XLogP0.29
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.20
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6,7-dimethyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one?
The IUPAC name of 6,7-dimethyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one (CID 135581429) is 6,7-dimethyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one.
What is the SMILES notation for 6,7-dimethyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one?
The canonical SMILES for 6,7-dimethyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one is Cc1nc2n(c(=O)c1C)CCN2.
What is the InChIKey of 6,7-dimethyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one?
The InChIKey is NGNOEROYVOIDIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O/c1-5-6(2)10-8-9-3-4-11(8)7(5)12/h3-4H2,1-2H3,(H,9,10).
What are the key properties of 6,7-dimethyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one?
6,7-dimethyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one has a molecular weight of 165.20 g/mol, XLogP of 0.29, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one is sourced from PubChem (CID 135581429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).