4-ethoxy-6-(2-methylpyrrolidin-1-yl)pyrimidine

C11H17N3O — CID 133484854

IUPAC4-ethoxy-6-(2-methylpyrrolidin-1-yl)pyrimidine
SMILESCCOc1cc(N2CCCC2C)ncn1
InChIInChI=1S/C11H17N3O/c1-3-15-11-7-10(12-8-13-11)14-6-4-5-9(14)2/h7-9H,3-6H2,1-2H3
InChIKeyZPZCIWSEBYAFNQ-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.86
Rot. Bonds3

About 4-ethoxy-6-(2-methylpyrrolidin-1-yl)pyrimidine

4-ethoxy-6-(2-methylpyrrolidin-1-yl)pyrimidine (PubChem CID 133484854) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 4-ethoxy-6-(2-methylpyrrolidin-1-yl)pyrimidine.

Molecular Properties

Compound Name4-ethoxy-6-(2-methylpyrrolidin-1-yl)pyrimidine
PubChem CID133484854
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name4-ethoxy-6-(2-methylpyrrolidin-1-yl)pyrimidine
SMILESCCOc1cc(N2CCCC2C)ncn1
InChIInChI=1S/C11H17N3O/c1-3-15-11-7-10(12-8-13-11)14-6-4-5-9(14)2/h7-9H,3-6H2,1-2H3
InChIKeyZPZCIWSEBYAFNQ-UHFFFAOYSA-N
XLogP1.86
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-ethoxy-6-(2-methylpyrrolidin-1-yl)pyrimidine 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-ethoxy-6-(2-methylpyrrolidin-1-yl)pyrimidine?
The IUPAC name of 4-ethoxy-6-(2-methylpyrrolidin-1-yl)pyrimidine (CID 133484854) is 4-ethoxy-6-(2-methylpyrrolidin-1-yl)pyrimidine.
What is the SMILES notation for 4-ethoxy-6-(2-methylpyrrolidin-1-yl)pyrimidine?
The canonical SMILES for 4-ethoxy-6-(2-methylpyrrolidin-1-yl)pyrimidine is CCOc1cc(N2CCCC2C)ncn1.
What is the InChIKey of 4-ethoxy-6-(2-methylpyrrolidin-1-yl)pyrimidine?
The InChIKey is ZPZCIWSEBYAFNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-3-15-11-7-10(12-8-13-11)14-6-4-5-9(14)2/h7-9H,3-6H2,1-2H3.
What are the key properties of 4-ethoxy-6-(2-methylpyrrolidin-1-yl)pyrimidine?
4-ethoxy-6-(2-methylpyrrolidin-1-yl)pyrimidine has a molecular weight of 207.28 g/mol, XLogP of 1.86, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-6-(2-methylpyrrolidin-1-yl)pyrimidine is sourced from PubChem (CID 133484854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).