4-(dimethoxymethyl)-2-(1-methoxyethyl)pyrimidine

C10H16N2O3 — CID 115531727

IUPAC4-(dimethoxymethyl)-2-(1-methoxyethyl)pyrimidine
SMILESCOC(C)c1nccc(C(OC)OC)n1
InChIInChI=1S/C10H16N2O3/c1-7(13-2)9-11-6-5-8(12-9)10(14-3)15-4/h5-7,10H,1-4H3
InChIKeyRVGDIQFKSQUGIH-UHFFFAOYSA-N
MW212.25 g/mol
LogP1.48
Rot. Bonds5

About 4-(dimethoxymethyl)-2-(1-methoxyethyl)pyrimidine

4-(dimethoxymethyl)-2-(1-methoxyethyl)pyrimidine (PubChem CID 115531727) has the molecular formula C10H16N2O3 and a molecular weight of 212.25 g/mol. Its IUPAC name is 4-(dimethoxymethyl)-2-(1-methoxyethyl)pyrimidine.

Molecular Properties

Compound Name4-(dimethoxymethyl)-2-(1-methoxyethyl)pyrimidine
PubChem CID115531727
Molecular FormulaC10H16N2O3
Molecular Weight212.25 g/mol
Exact Mass212.12
IUPAC Name4-(dimethoxymethyl)-2-(1-methoxyethyl)pyrimidine
SMILESCOC(C)c1nccc(C(OC)OC)n1
InChIInChI=1S/C10H16N2O3/c1-7(13-2)9-11-6-5-8(12-9)10(14-3)15-4/h5-7,10H,1-4H3
InChIKeyRVGDIQFKSQUGIH-UHFFFAOYSA-N
XLogP1.48
TPSA53.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 51.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 4-(dimethoxymethyl)-2-(1-methoxyethyl)pyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-cyclohexyl-4-(dimethoxymethyl)pyrimidine
CID 115531674
sodium 4-(dimethoxymethyl)-2-methylsulfanylpyrimidine
CID 22722063
4-(dimethoxymethyl)-2-phenylpyrimidine
CID 79020331
2-(2,3-dihydro-1H-inden-2-yl)-4-(dimethoxymethyl)pyrimidine
CID 115531721
2-[4-(dimethoxymethyl)pyrimidin-2-yl]ethanamine
CID 55262615
3-[4-(dimethoxymethyl)pyrimidin-2-yl]-8-methyl-8-azabicyclo[3.2.1]octane
CID 115998463
2-(3,5-dichlorophenyl)-4-(dimethoxymethyl)pyrimidine
CID 114015736
4-(dimethoxymethyl)-2-(1-methoxycyclobutyl)pyrimidine
CID 116731031
4-(dimethoxymethyl)-N-propylpyrimidin-2-amine
CID 146441293
4-(dimethoxymethyl)-2-(pyridin-4-ylmethyl)pyrimidine
CID 115531673
4-(dimethoxymethyl)-2-(2-methylfuran-3-yl)pyrimidine
CID 104790809
4-(dimethoxymethyl)-2-(1-methoxycyclohexyl)pyrimidine
CID 116778439

Frequently Asked Questions

What is the IUPAC name of 4-(dimethoxymethyl)-2-(1-methoxyethyl)pyrimidine?
The IUPAC name of 4-(dimethoxymethyl)-2-(1-methoxyethyl)pyrimidine (CID 115531727) is 4-(dimethoxymethyl)-2-(1-methoxyethyl)pyrimidine.
What is the SMILES notation for 4-(dimethoxymethyl)-2-(1-methoxyethyl)pyrimidine?
The canonical SMILES for 4-(dimethoxymethyl)-2-(1-methoxyethyl)pyrimidine is COC(C)c1nccc(C(OC)OC)n1.
What is the InChIKey of 4-(dimethoxymethyl)-2-(1-methoxyethyl)pyrimidine?
The InChIKey is RVGDIQFKSQUGIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3/c1-7(13-2)9-11-6-5-8(12-9)10(14-3)15-4/h5-7,10H,1-4H3.
What are the key properties of 4-(dimethoxymethyl)-2-(1-methoxyethyl)pyrimidine?
4-(dimethoxymethyl)-2-(1-methoxyethyl)pyrimidine has a molecular weight of 212.25 g/mol, XLogP of 1.48, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethoxymethyl)-2-(1-methoxyethyl)pyrimidine is sourced from PubChem (CID 115531727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).