2-amino-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one

C8H10N4O — CID 83679490

IUPAC2-amino-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one
SMILESCc1nc(N)nc2c1C(=O)NCC2
InChIInChI=1S/C8H10N4O/c1-4-6-5(12-8(9)11-4)2-3-10-7(6)13/h2-3H2,1H3,(H,10,13)(H2,9,11,12)
InChIKeyBVTKUIPXPHBCHI-UHFFFAOYSA-N
MW178.19 g/mol
LogP-0.35
Rot. Bonds

About 2-amino-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one

2-amino-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one (PubChem CID 83679490) has the molecular formula C8H10N4O and a molecular weight of 178.19 g/mol. Its IUPAC name is 2-amino-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one.

Molecular Properties

Compound Name2-amino-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one
PubChem CID83679490
Molecular FormulaC8H10N4O
Molecular Weight178.19 g/mol
Exact Mass178.09
IUPAC Name2-amino-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one
SMILESCc1nc(N)nc2c1C(=O)NCC2
InChIInChI=1S/C8H10N4O/c1-4-6-5(12-8(9)11-4)2-3-10-7(6)13/h2-3H2,1H3,(H,10,13)(H2,9,11,12)
InChIKeyBVTKUIPXPHBCHI-UHFFFAOYSA-N
XLogP-0.35
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.19
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-amino-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-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-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one?
The IUPAC name of 2-amino-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one (CID 83679490) is 2-amino-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one.
What is the SMILES notation for 2-amino-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one?
The canonical SMILES for 2-amino-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one is Cc1nc(N)nc2c1C(=O)NCC2.
What is the InChIKey of 2-amino-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one?
The InChIKey is BVTKUIPXPHBCHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4O/c1-4-6-5(12-8(9)11-4)2-3-10-7(6)13/h2-3H2,1H3,(H,10,13)(H2,9,11,12).
What are the key properties of 2-amino-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one?
2-amino-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one has a molecular weight of 178.19 g/mol, XLogP of -0.35, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one is sourced from PubChem (CID 83679490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).