2-amino-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one

C8H11N3O — CID 83873338

IUPAC2-amino-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
SMILESNc1cc(=O)n2c(n1)CCCC2
InChIInChI=1S/C8H11N3O/c9-6-5-8(12)11-4-2-1-3-7(11)10-6/h5H,1-4,9H2
InChIKeyXQMRGIDFCFQWEF-UHFFFAOYSA-N
MW165.20 g/mol
LogP0.16
Rot. Bonds

About 2-amino-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one

2-amino-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one (PubChem CID 83873338) has the molecular formula C8H11N3O and a molecular weight of 165.20 g/mol. Its IUPAC name is 2-amino-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name2-amino-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
PubChem CID83873338
Molecular FormulaC8H11N3O
Molecular Weight165.20 g/mol
Exact Mass165.09
IUPAC Name2-amino-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
SMILESNc1cc(=O)n2c(n1)CCCC2
InChIInChI=1S/C8H11N3O/c9-6-5-8(12)11-4-2-1-3-7(11)10-6/h5H,1-4,9H2
InChIKeyXQMRGIDFCFQWEF-UHFFFAOYSA-N
XLogP0.16
TPSA60.91 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 ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-amino-6,7,8,9-tetrahydropyrido[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 2-amino-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 2-amino-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one (CID 83873338) is 2-amino-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 2-amino-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 2-amino-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one is Nc1cc(=O)n2c(n1)CCCC2.
What is the InChIKey of 2-amino-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one?
The InChIKey is XQMRGIDFCFQWEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O/c9-6-5-8(12)11-4-2-1-3-7(11)10-6/h5H,1-4,9H2.
What are the key properties of 2-amino-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one?
2-amino-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one has a molecular weight of 165.20 g/mol, XLogP of 0.16, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 83873338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).