1,3-dimethyl-5-(methylamino)pyrido[4,3-d]pyrimidine-2,4-dione

C10H12N4O2 — CID 3086911

IUPAC1,3-dimethyl-5-(methylamino)pyrido[4,3-d]pyrimidine-2,4-dione
SMILESCNc1nccc2c1c(=O)n(C)c(=O)n2C
InChIInChI=1S/C10H12N4O2/c1-11-8-7-6(4-5-12-8)13(2)10(16)14(3)9(7)15/h4-5H,1-3H3,(H,11,12)
InChIKeyQJMXSZYSRJJKGD-UHFFFAOYSA-N
MW220.23 g/mol
LogP-0.33
Rot. Bonds1

About 1,3-dimethyl-5-(methylamino)pyrido[4,3-d]pyrimidine-2,4-dione

1,3-dimethyl-5-(methylamino)pyrido[4,3-d]pyrimidine-2,4-dione (PubChem CID 3086911) has the molecular formula C10H12N4O2 and a molecular weight of 220.23 g/mol. Its IUPAC name is 1,3-dimethyl-5-(methylamino)pyrido[4,3-d]pyrimidine-2,4-dione.

Molecular Properties

Compound Name1,3-dimethyl-5-(methylamino)pyrido[4,3-d]pyrimidine-2,4-dione
PubChem CID3086911
Molecular FormulaC10H12N4O2
Molecular Weight220.23 g/mol
Exact Mass220.10
IUPAC Name1,3-dimethyl-5-(methylamino)pyrido[4,3-d]pyrimidine-2,4-dione
SMILESCNc1nccc2c1c(=O)n(C)c(=O)n2C
InChIInChI=1S/C10H12N4O2/c1-11-8-7-6(4-5-12-8)13(2)10(16)14(3)9(7)15/h4-5H,1-3H3,(H,11,12)
InChIKeyQJMXSZYSRJJKGD-UHFFFAOYSA-N
XLogP-0.33
TPSA68.92 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.23
LogP ≤ 5-0.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1,3-dimethyl-5-(methylamino)pyrido[4,3-d]pyrimidine-2,4-dione 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 1,3-dimethyl-5-(methylamino)pyrido[4,3-d]pyrimidine-2,4-dione?
The IUPAC name of 1,3-dimethyl-5-(methylamino)pyrido[4,3-d]pyrimidine-2,4-dione (CID 3086911) is 1,3-dimethyl-5-(methylamino)pyrido[4,3-d]pyrimidine-2,4-dione.
What is the SMILES notation for 1,3-dimethyl-5-(methylamino)pyrido[4,3-d]pyrimidine-2,4-dione?
The canonical SMILES for 1,3-dimethyl-5-(methylamino)pyrido[4,3-d]pyrimidine-2,4-dione is CNc1nccc2c1c(=O)n(C)c(=O)n2C.
What is the InChIKey of 1,3-dimethyl-5-(methylamino)pyrido[4,3-d]pyrimidine-2,4-dione?
The InChIKey is QJMXSZYSRJJKGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O2/c1-11-8-7-6(4-5-12-8)13(2)10(16)14(3)9(7)15/h4-5H,1-3H3,(H,11,12).
What are the key properties of 1,3-dimethyl-5-(methylamino)pyrido[4,3-d]pyrimidine-2,4-dione?
1,3-dimethyl-5-(methylamino)pyrido[4,3-d]pyrimidine-2,4-dione has a molecular weight of 220.23 g/mol, XLogP of -0.33, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-5-(methylamino)pyrido[4,3-d]pyrimidine-2,4-dione is sourced from PubChem (CID 3086911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).