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

C9H13N3O — CID 115015393

IUPAC3-amino-7-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
SMILESCC1CCc2ncc(N)c(=O)n2C1
InChIInChI=1S/C9H13N3O/c1-6-2-3-8-11-4-7(10)9(13)12(8)5-6/h4,6H,2-3,5,10H2,1H3
InChIKeyUJNHTRKXFVFOIO-UHFFFAOYSA-N
MW179.22 g/mol
LogP0.41
Rot. Bonds

About 3-amino-7-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one

3-amino-7-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one (PubChem CID 115015393) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is 3-amino-7-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name3-amino-7-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
PubChem CID115015393
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC Name3-amino-7-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
SMILESCC1CCc2ncc(N)c(=O)n2C1
InChIInChI=1S/C9H13N3O/c1-6-2-3-8-11-4-7(10)9(13)12(8)5-6/h4,6H,2-3,5,10H2,1H3
InChIKeyUJNHTRKXFVFOIO-UHFFFAOYSA-N
XLogP0.41
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4H-Pyrido[1,2-a]pyrimidin-4-one, 6,7,8,9-tetrahydro, 7-methyl
CID 529097
4H-Pyrido[1,2-a]pyrimidin-4-one, 6,7,8,9-tetrahydro, 9-methyl
CID 529099
(6R)-6-methyl-3-(methylamino)-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
CID 58700505
4-Oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidine-2-carboxamide
CID 90891041
6-Methyl-3-(phosphanylamino)-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
CID 142093562
3-Amino-8-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
CID 10678918
N-(8-methyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-3-yl)acetamide
CID 10680507
3-amino-4H,6H,7H,8H,9H-pyrido[1,2-a]pyrimidin-4-one
CID 10702198
N-(4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-3-yl)acetamide
CID 10703524
3-Amino-9-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
CID 10845077
2,9-Dimethyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
CID 12338966
2-methyl-5-piperidin-1-yl-1H-pyrimidin-6-one
CID 13463840

Frequently Asked Questions

What is the IUPAC name of 3-amino-7-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 3-amino-7-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one (CID 115015393) is 3-amino-7-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 3-amino-7-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 3-amino-7-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one is CC1CCc2ncc(N)c(=O)n2C1.
What is the InChIKey of 3-amino-7-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one?
The InChIKey is UJNHTRKXFVFOIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c1-6-2-3-8-11-4-7(10)9(13)12(8)5-6/h4,6H,2-3,5,10H2,1H3.
What are the key properties of 3-amino-7-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one?
3-amino-7-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one has a molecular weight of 179.22 g/mol, XLogP of 0.41, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-7-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 115015393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).