7-hydroxy-2,2,6-trimethyl-1,3-dihydroimidazo[1,2-a]pyrimidin-5-one

C9H13N3O2 — CID 137152216

IUPAC7-hydroxy-2,2,6-trimethyl-1,3-dihydroimidazo[1,2-a]pyrimidin-5-one
SMILESCc1c(O)nc2n(c1=O)CC(C)(C)N2
InChIInChI=1S/C9H13N3O2/c1-5-6(13)10-8-11-9(2,3)4-12(8)7(5)14/h13H,4H2,1-3H3,(H,10,11)
InChIKeyOPJSGSRUCBMLDI-UHFFFAOYSA-N
MW195.22 g/mol
LogP0.46
Rot. Bonds

About 7-hydroxy-2,2,6-trimethyl-1,3-dihydroimidazo[1,2-a]pyrimidin-5-one

7-hydroxy-2,2,6-trimethyl-1,3-dihydroimidazo[1,2-a]pyrimidin-5-one (PubChem CID 137152216) has the molecular formula C9H13N3O2 and a molecular weight of 195.22 g/mol. Its IUPAC name is 7-hydroxy-2,2,6-trimethyl-1,3-dihydroimidazo[1,2-a]pyrimidin-5-one.

Molecular Properties

Compound Name7-hydroxy-2,2,6-trimethyl-1,3-dihydroimidazo[1,2-a]pyrimidin-5-one
PubChem CID137152216
Molecular FormulaC9H13N3O2
Molecular Weight195.22 g/mol
Exact Mass195.10
IUPAC Name7-hydroxy-2,2,6-trimethyl-1,3-dihydroimidazo[1,2-a]pyrimidin-5-one
SMILESCc1c(O)nc2n(c1=O)CC(C)(C)N2
InChIInChI=1S/C9H13N3O2/c1-5-6(13)10-8-11-9(2,3)4-12(8)7(5)14/h13H,4H2,1-3H3,(H,10,11)
InChIKeyOPJSGSRUCBMLDI-UHFFFAOYSA-N
XLogP0.46
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-7-hydroxy-2-methyl-2-(trifluoromethyl)-2,3-dihydroimidazo[1,2-a]pyrimidin-5(1H)-one
CID 136069601
7-Hydroxy-2-methyl-2-(trifluoromethyl)-1,3-dihydroimidazo[1,2-a]pyrimidin-5-one
CID 136417765
(2R)-7-hydroxy-2-methyl-2-(trifluoromethyl)-1,3-dihydroimidazo[1,2-a]pyrimidin-5-one
CID 136417769
(2R)-6-fluoro-7-hydroxy-2-methyl-2-(trifluoromethyl)-1,3-dihydroimidazo[1,2-a]pyrimidin-5-one
CID 136417798
(S)-6-fluoro-7-hydroxy-2-methyl-2-(trifluoromethyl)-2,3-dihydroimidazo[1,2-a]pyrimidin-5(1H)-one
CID 136417799
6-Fluoro-7-hydroxy-2-methyl-2-(trifluoromethyl)-1,3-dihydroimidazo[1,2-a]pyrimidin-5-one
CID 136425423
(2S)-2-(1,1-difluoroethyl)-7-hydroxy-2-methyl-1,3-dihydroimidazo[1,2-a]pyrimidin-5-one
CID 136941862
ethane;6-fluoro-7-hydroxy-2-(trifluoromethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one
CID 145686130
6,7-dimethyl-1H,2H,3H,5H-imidazo[1,2-a]pyrimidin-5-one
CID 135581429
7-hydroxy-2,2-dimethyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one
CID 136269314
4-hydroxy-5-methyl-2-pyrrolidin-1-yl-1H-pyrimidin-6-one
CID 63613107
7-Hydroxy-6-methyl-1h,2h,3h,5h-imidazolidino[1,2-a]pyrimidin-5-one
CID 136923866

Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-2,2,6-trimethyl-1,3-dihydroimidazo[1,2-a]pyrimidin-5-one?
The IUPAC name of 7-hydroxy-2,2,6-trimethyl-1,3-dihydroimidazo[1,2-a]pyrimidin-5-one (CID 137152216) is 7-hydroxy-2,2,6-trimethyl-1,3-dihydroimidazo[1,2-a]pyrimidin-5-one.
What is the SMILES notation for 7-hydroxy-2,2,6-trimethyl-1,3-dihydroimidazo[1,2-a]pyrimidin-5-one?
The canonical SMILES for 7-hydroxy-2,2,6-trimethyl-1,3-dihydroimidazo[1,2-a]pyrimidin-5-one is Cc1c(O)nc2n(c1=O)CC(C)(C)N2.
What is the InChIKey of 7-hydroxy-2,2,6-trimethyl-1,3-dihydroimidazo[1,2-a]pyrimidin-5-one?
The InChIKey is OPJSGSRUCBMLDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O2/c1-5-6(13)10-8-11-9(2,3)4-12(8)7(5)14/h13H,4H2,1-3H3,(H,10,11).
What are the key properties of 7-hydroxy-2,2,6-trimethyl-1,3-dihydroimidazo[1,2-a]pyrimidin-5-one?
7-hydroxy-2,2,6-trimethyl-1,3-dihydroimidazo[1,2-a]pyrimidin-5-one has a molecular weight of 195.22 g/mol, XLogP of 0.46, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-2,2,6-trimethyl-1,3-dihydroimidazo[1,2-a]pyrimidin-5-one is sourced from PubChem (CID 137152216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).