3-methyl-N-(6-methyl-2-pyridinyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide

C12H12N4O3 — CID 71778346

IUPAC3-methyl-N-(6-methyl-2-pyridinyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide
SMILESCc1cccc(NC(=O)c2c[nH]c(=O)n(C)c2=O)n1
InChIInChI=1S/C12H12N4O3/c1-7-4-3-5-9(14-7)15-10(17)8-6-13-12(19)16(2)11(8)18/h3-6H,1-2H3,(H,13,19)(H,14,15,17)
InChIKeyWFQLPIFMFUCSQJ-UHFFFAOYSA-N
MW260.25 g/mol
LogP0.03
Rot. Bonds2

About 3-methyl-N-(6-methyl-2-pyridinyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide

3-methyl-N-(6-methyl-2-pyridinyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide (PubChem CID 71778346) has the molecular formula C12H12N4O3 and a molecular weight of 260.25 g/mol. Its IUPAC name is 3-methyl-N-(6-methyl-2-pyridinyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(6-methyl-2-pyridinyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide
PubChem CID71778346
Molecular FormulaC12H12N4O3
Molecular Weight260.25 g/mol
Exact Mass260.09
IUPAC Name3-methyl-N-(6-methyl-2-pyridinyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide
SMILESCc1cccc(NC(=O)c2c[nH]c(=O)n(C)c2=O)n1
InChIInChI=1S/C12H12N4O3/c1-7-4-3-5-9(14-7)15-10(17)8-6-13-12(19)16(2)11(8)18/h3-6H,1-2H3,(H,13,19)(H,14,15,17)
InChIKeyWFQLPIFMFUCSQJ-UHFFFAOYSA-N
XLogP0.03
TPSA96.85 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.25
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-methyl-N-(6-methyl-2-pyridinyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide 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 3-methyl-N-(6-methyl-2-pyridinyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide?
The IUPAC name of 3-methyl-N-(6-methyl-2-pyridinyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide (CID 71778346) is 3-methyl-N-(6-methyl-2-pyridinyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide.
What is the SMILES notation for 3-methyl-N-(6-methyl-2-pyridinyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide?
The canonical SMILES for 3-methyl-N-(6-methyl-2-pyridinyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide is Cc1cccc(NC(=O)c2c[nH]c(=O)n(C)c2=O)n1.
What is the InChIKey of 3-methyl-N-(6-methyl-2-pyridinyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide?
The InChIKey is WFQLPIFMFUCSQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4O3/c1-7-4-3-5-9(14-7)15-10(17)8-6-13-12(19)16(2)11(8)18/h3-6H,1-2H3,(H,13,19)(H,14,15,17).
What are the key properties of 3-methyl-N-(6-methyl-2-pyridinyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide?
3-methyl-N-(6-methyl-2-pyridinyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide has a molecular weight of 260.25 g/mol, XLogP of 0.03, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(6-methyl-2-pyridinyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide is sourced from PubChem (CID 71778346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).