8-amino-9-hydroxy-2-methylpyrido[1,2-a]pyrimidin-4-one

C9H9N3O2 — CID 870036

IUPAC8-amino-9-hydroxy-2-methylpyrido[1,2-a]pyrimidin-4-one
SMILESCc1cc(=O)n2ccc(N)c(O)c2n1
InChIInChI=1S/C9H9N3O2/c1-5-4-7(13)12-3-2-6(10)8(14)9(12)11-5/h2-4,14H,10H2,1H3
InChIKeyLHDATCZOUJTWRO-UHFFFAOYSA-N
MW191.19 g/mol
LogP0.29
Rot. Bonds

About 8-amino-9-hydroxy-2-methylpyrido[1,2-a]pyrimidin-4-one

8-amino-9-hydroxy-2-methylpyrido[1,2-a]pyrimidin-4-one (PubChem CID 870036) has the molecular formula C9H9N3O2 and a molecular weight of 191.19 g/mol. Its IUPAC name is 8-amino-9-hydroxy-2-methylpyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name8-amino-9-hydroxy-2-methylpyrido[1,2-a]pyrimidin-4-one
PubChem CID870036
Molecular FormulaC9H9N3O2
Molecular Weight191.19 g/mol
Exact Mass191.07
IUPAC Name8-amino-9-hydroxy-2-methylpyrido[1,2-a]pyrimidin-4-one
SMILESCc1cc(=O)n2ccc(N)c(O)c2n1
InChIInChI=1S/C9H9N3O2/c1-5-4-7(13)12-3-2-6(10)8(14)9(12)11-5/h2-4,14H,10H2,1H3
InChIKeyLHDATCZOUJTWRO-UHFFFAOYSA-N
XLogP0.29
TPSA80.62 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 8-amino-9-hydroxy-2-methylpyrido[1,2-a]pyrimidin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 8-amino-9-hydroxy-2-methylpyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 8-amino-9-hydroxy-2-methylpyrido[1,2-a]pyrimidin-4-one (CID 870036) is 8-amino-9-hydroxy-2-methylpyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 8-amino-9-hydroxy-2-methylpyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 8-amino-9-hydroxy-2-methylpyrido[1,2-a]pyrimidin-4-one is Cc1cc(=O)n2ccc(N)c(O)c2n1.
What is the InChIKey of 8-amino-9-hydroxy-2-methylpyrido[1,2-a]pyrimidin-4-one?
The InChIKey is LHDATCZOUJTWRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O2/c1-5-4-7(13)12-3-2-6(10)8(14)9(12)11-5/h2-4,14H,10H2,1H3.
What are the key properties of 8-amino-9-hydroxy-2-methylpyrido[1,2-a]pyrimidin-4-one?
8-amino-9-hydroxy-2-methylpyrido[1,2-a]pyrimidin-4-one has a molecular weight of 191.19 g/mol, XLogP of 0.29, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-amino-9-hydroxy-2-methylpyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 870036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).