2-(4,6-dimethylpyrimidin-5-yl)acetamide

C8H11N3O — CID 130683923

IUPAC2-(4,6-dimethylpyrimidin-5-yl)acetamide
SMILESCc1ncnc(C)c1CC(N)=O
InChIInChI=1S/C8H11N3O/c1-5-7(3-8(9)12)6(2)11-4-10-5/h4H,3H2,1-2H3,(H2,9,12)
InChIKeyIETRGTUDVRPRRR-UHFFFAOYSA-N
MW165.20 g/mol
LogP0.12
Rot. Bonds2

About 2-(4,6-dimethylpyrimidin-5-yl)acetamide

2-(4,6-dimethylpyrimidin-5-yl)acetamide (PubChem CID 130683923) has the molecular formula C8H11N3O and a molecular weight of 165.20 g/mol. Its IUPAC name is 2-(4,6-dimethylpyrimidin-5-yl)acetamide.

Molecular Properties

Compound Name2-(4,6-dimethylpyrimidin-5-yl)acetamide
PubChem CID130683923
Molecular FormulaC8H11N3O
Molecular Weight165.20 g/mol
Exact Mass165.09
IUPAC Name2-(4,6-dimethylpyrimidin-5-yl)acetamide
SMILESCc1ncnc(C)c1CC(N)=O
InChIInChI=1S/C8H11N3O/c1-5-7(3-8(9)12)6(2)11-4-10-5/h4H,3H2,1-2H3,(H2,9,12)
InChIKeyIETRGTUDVRPRRR-UHFFFAOYSA-N
XLogP0.12
TPSA68.87 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.20
LogP ≤ 50.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(4,6-dimethylpyrimidin-5-yl)acetamide 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-(4,6-dimethylpyrimidin-5-yl)acetamide?
The IUPAC name of 2-(4,6-dimethylpyrimidin-5-yl)acetamide (CID 130683923) is 2-(4,6-dimethylpyrimidin-5-yl)acetamide.
What is the SMILES notation for 2-(4,6-dimethylpyrimidin-5-yl)acetamide?
The canonical SMILES for 2-(4,6-dimethylpyrimidin-5-yl)acetamide is Cc1ncnc(C)c1CC(N)=O.
What is the InChIKey of 2-(4,6-dimethylpyrimidin-5-yl)acetamide?
The InChIKey is IETRGTUDVRPRRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O/c1-5-7(3-8(9)12)6(2)11-4-10-5/h4H,3H2,1-2H3,(H2,9,12).
What are the key properties of 2-(4,6-dimethylpyrimidin-5-yl)acetamide?
2-(4,6-dimethylpyrimidin-5-yl)acetamide has a molecular weight of 165.20 g/mol, XLogP of 0.12, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,6-dimethylpyrimidin-5-yl)acetamide is sourced from PubChem (CID 130683923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).