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

C7H9N3O2 — CID 136923866

IUPAC7-hydroxy-6-methyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one
SMILESCc1c(O)nc2n(c1=O)CCN2
InChIInChI=1S/C7H9N3O2/c1-4-5(11)9-7-8-2-3-10(7)6(4)12/h11H,2-3H2,1H3,(H,8,9)
InChIKeyPGDNOESVYQWIGT-UHFFFAOYSA-N
MW167.17 g/mol
LogP-0.32
Rot. Bonds

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

7-hydroxy-6-methyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one (PubChem CID 136923866) has the molecular formula C7H9N3O2 and a molecular weight of 167.17 g/mol. Its IUPAC name is 7-hydroxy-6-methyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one.

Molecular Properties

Compound Name7-hydroxy-6-methyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one
PubChem CID136923866
Molecular FormulaC7H9N3O2
Molecular Weight167.17 g/mol
Exact Mass167.07
IUPAC Name7-hydroxy-6-methyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one
SMILESCc1c(O)nc2n(c1=O)CCN2
InChIInChI=1S/C7H9N3O2/c1-4-5(11)9-7-8-2-3-10(7)6(4)12/h11H,2-3H2,1H3,(H,8,9)
InChIKeyPGDNOESVYQWIGT-UHFFFAOYSA-N
XLogP-0.32
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.17
LogP ≤ 5-0.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-6-methyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one?
The IUPAC name of 7-hydroxy-6-methyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one (CID 136923866) is 7-hydroxy-6-methyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one.
What is the SMILES notation for 7-hydroxy-6-methyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one?
The canonical SMILES for 7-hydroxy-6-methyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one is Cc1c(O)nc2n(c1=O)CCN2.
What is the InChIKey of 7-hydroxy-6-methyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one?
The InChIKey is PGDNOESVYQWIGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O2/c1-4-5(11)9-7-8-2-3-10(7)6(4)12/h11H,2-3H2,1H3,(H,8,9).
What are the key properties of 7-hydroxy-6-methyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one?
7-hydroxy-6-methyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one has a molecular weight of 167.17 g/mol, XLogP of -0.32, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-6-methyl-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one is sourced from PubChem (CID 136923866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).