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

C9H10N4O — CID 56664931

IUPAC4-amino-2,7-dimethyl-6H-pyrido[4,3-d]pyrimidin-5-one
SMILESCc1nc(N)c2c(=O)[nH]c(C)cc2n1
InChIInChI=1S/C9H10N4O/c1-4-3-6-7(9(14)11-4)8(10)13-5(2)12-6/h3H,1-2H3,(H,11,14)(H2,10,12,13)
InChIKeyKWANLRQXAMAQOR-UHFFFAOYSA-N
MW190.21 g/mol
LogP0.52
Rot. Bonds

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

4-amino-2,7-dimethyl-6H-pyrido[4,3-d]pyrimidin-5-one (PubChem CID 56664931) has the molecular formula C9H10N4O and a molecular weight of 190.21 g/mol. Its IUPAC name is 4-amino-2,7-dimethyl-6H-pyrido[4,3-d]pyrimidin-5-one.

Molecular Properties

Compound Name4-amino-2,7-dimethyl-6H-pyrido[4,3-d]pyrimidin-5-one
PubChem CID56664931
Molecular FormulaC9H10N4O
Molecular Weight190.21 g/mol
Exact Mass190.09
IUPAC Name4-amino-2,7-dimethyl-6H-pyrido[4,3-d]pyrimidin-5-one
SMILESCc1nc(N)c2c(=O)[nH]c(C)cc2n1
InChIInChI=1S/C9H10N4O/c1-4-3-6-7(9(14)11-4)8(10)13-5(2)12-6/h3H,1-2H3,(H,11,14)(H2,10,12,13)
InChIKeyKWANLRQXAMAQOR-UHFFFAOYSA-N
XLogP0.52
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-amino-2,7-dimethyl-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 4-amino-2,7-dimethyl-6H-pyrido[4,3-d]pyrimidin-5-one?
The IUPAC name of 4-amino-2,7-dimethyl-6H-pyrido[4,3-d]pyrimidin-5-one (CID 56664931) is 4-amino-2,7-dimethyl-6H-pyrido[4,3-d]pyrimidin-5-one.
What is the SMILES notation for 4-amino-2,7-dimethyl-6H-pyrido[4,3-d]pyrimidin-5-one?
The canonical SMILES for 4-amino-2,7-dimethyl-6H-pyrido[4,3-d]pyrimidin-5-one is Cc1nc(N)c2c(=O)[nH]c(C)cc2n1.
What is the InChIKey of 4-amino-2,7-dimethyl-6H-pyrido[4,3-d]pyrimidin-5-one?
The InChIKey is KWANLRQXAMAQOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O/c1-4-3-6-7(9(14)11-4)8(10)13-5(2)12-6/h3H,1-2H3,(H,11,14)(H2,10,12,13).
What are the key properties of 4-amino-2,7-dimethyl-6H-pyrido[4,3-d]pyrimidin-5-one?
4-amino-2,7-dimethyl-6H-pyrido[4,3-d]pyrimidin-5-one has a molecular weight of 190.21 g/mol, XLogP of 0.52, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2,7-dimethyl-6H-pyrido[4,3-d]pyrimidin-5-one is sourced from PubChem (CID 56664931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).