7-ethoxy-2-methylimidazo[1,2-a]pyrimidine-6-carboxylic acid

C10H11N3O3 — CID 168895107

IUPAC7-ethoxy-2-methylimidazo[1,2-a]pyrimidine-6-carboxylic acid
SMILESCCOc1nc2nc(C)cn2cc1C(=O)O
InChIInChI=1S/C10H11N3O3/c1-3-16-8-7(9(14)15)5-13-4-6(2)11-10(13)12-8/h4-5H,3H2,1-2H3,(H,14,15)
InChIKeyXATHZOBJUBAWFN-UHFFFAOYSA-N
MW221.22 g/mol
LogP1.13
Rot. Bonds3

About 7-ethoxy-2-methylimidazo[1,2-a]pyrimidine-6-carboxylic acid

7-ethoxy-2-methylimidazo[1,2-a]pyrimidine-6-carboxylic acid (PubChem CID 168895107) has the molecular formula C10H11N3O3 and a molecular weight of 221.22 g/mol. Its IUPAC name is 7-ethoxy-2-methylimidazo[1,2-a]pyrimidine-6-carboxylic acid.

Molecular Properties

Compound Name7-ethoxy-2-methylimidazo[1,2-a]pyrimidine-6-carboxylic acid
PubChem CID168895107
Molecular FormulaC10H11N3O3
Molecular Weight221.22 g/mol
Exact Mass221.08
IUPAC Name7-ethoxy-2-methylimidazo[1,2-a]pyrimidine-6-carboxylic acid
SMILESCCOc1nc2nc(C)cn2cc1C(=O)O
InChIInChI=1S/C10H11N3O3/c1-3-16-8-7(9(14)15)5-13-4-6(2)11-10(13)12-8/h4-5H,3H2,1-2H3,(H,14,15)
InChIKeyXATHZOBJUBAWFN-UHFFFAOYSA-N
XLogP1.13
TPSA76.72 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.22
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 7-ethoxy-2-methylimidazo[1,2-a]pyrimidine-6-carboxylic acid 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 7-ethoxy-2-methylimidazo[1,2-a]pyrimidine-6-carboxylic acid?
The IUPAC name of 7-ethoxy-2-methylimidazo[1,2-a]pyrimidine-6-carboxylic acid (CID 168895107) is 7-ethoxy-2-methylimidazo[1,2-a]pyrimidine-6-carboxylic acid.
What is the SMILES notation for 7-ethoxy-2-methylimidazo[1,2-a]pyrimidine-6-carboxylic acid?
The canonical SMILES for 7-ethoxy-2-methylimidazo[1,2-a]pyrimidine-6-carboxylic acid is CCOc1nc2nc(C)cn2cc1C(=O)O.
What is the InChIKey of 7-ethoxy-2-methylimidazo[1,2-a]pyrimidine-6-carboxylic acid?
The InChIKey is XATHZOBJUBAWFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O3/c1-3-16-8-7(9(14)15)5-13-4-6(2)11-10(13)12-8/h4-5H,3H2,1-2H3,(H,14,15).
What are the key properties of 7-ethoxy-2-methylimidazo[1,2-a]pyrimidine-6-carboxylic acid?
7-ethoxy-2-methylimidazo[1,2-a]pyrimidine-6-carboxylic acid has a molecular weight of 221.22 g/mol, XLogP of 1.13, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethoxy-2-methylimidazo[1,2-a]pyrimidine-6-carboxylic acid is sourced from PubChem (CID 168895107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).