3-(3-methylimidazo[1,2-a]pyrimidin-6-yl)propanoic acid

C10H11N3O2 — CID 83832769

IUPAC3-(3-methylimidazo[1,2-a]pyrimidin-6-yl)propanoic acid
SMILESCc1cnc2ncc(CCC(=O)O)cn12
InChIInChI=1S/C10H11N3O2/c1-7-4-11-10-12-5-8(6-13(7)10)2-3-9(14)15/h4-6H,2-3H2,1H3,(H,14,15)
InChIKeyVFJCECRAFTVLRL-UHFFFAOYSA-N
MW205.22 g/mol
LogP1.05
Rot. Bonds3

About 3-(3-methylimidazo[1,2-a]pyrimidin-6-yl)propanoic acid

3-(3-methylimidazo[1,2-a]pyrimidin-6-yl)propanoic acid (PubChem CID 83832769) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is 3-(3-methylimidazo[1,2-a]pyrimidin-6-yl)propanoic acid.

Molecular Properties

Compound Name3-(3-methylimidazo[1,2-a]pyrimidin-6-yl)propanoic acid
PubChem CID83832769
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Name3-(3-methylimidazo[1,2-a]pyrimidin-6-yl)propanoic acid
SMILESCc1cnc2ncc(CCC(=O)O)cn12
InChIInChI=1S/C10H11N3O2/c1-7-4-11-10-12-5-8(6-13(7)10)2-3-9(14)15/h4-6H,2-3H2,1H3,(H,14,15)
InChIKeyVFJCECRAFTVLRL-UHFFFAOYSA-N
XLogP1.05
TPSA67.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(3-methylimidazo[1,2-a]pyrimidin-6-yl)propanoic 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 3-(3-methylimidazo[1,2-a]pyrimidin-6-yl)propanoic acid?
The IUPAC name of 3-(3-methylimidazo[1,2-a]pyrimidin-6-yl)propanoic acid (CID 83832769) is 3-(3-methylimidazo[1,2-a]pyrimidin-6-yl)propanoic acid.
What is the SMILES notation for 3-(3-methylimidazo[1,2-a]pyrimidin-6-yl)propanoic acid?
The canonical SMILES for 3-(3-methylimidazo[1,2-a]pyrimidin-6-yl)propanoic acid is Cc1cnc2ncc(CCC(=O)O)cn12.
What is the InChIKey of 3-(3-methylimidazo[1,2-a]pyrimidin-6-yl)propanoic acid?
The InChIKey is VFJCECRAFTVLRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c1-7-4-11-10-12-5-8(6-13(7)10)2-3-9(14)15/h4-6H,2-3H2,1H3,(H,14,15).
What are the key properties of 3-(3-methylimidazo[1,2-a]pyrimidin-6-yl)propanoic acid?
3-(3-methylimidazo[1,2-a]pyrimidin-6-yl)propanoic acid has a molecular weight of 205.22 g/mol, XLogP of 1.05, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methylimidazo[1,2-a]pyrimidin-6-yl)propanoic acid is sourced from PubChem (CID 83832769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).