2-(furan-2-yl)imidazo[1,2-a]pyrimidine-3-carbaldehyde

C11H7N3O2 — CID 15502894

IUPAC2-(furan-2-yl)imidazo[1,2-a]pyrimidine-3-carbaldehyde
SMILESO=Cc1c(-c2ccco2)nc2ncccn12
InChIInChI=1S/C11H7N3O2/c15-7-8-10(9-3-1-6-16-9)13-11-12-4-2-5-14(8)11/h1-7H
InChIKeyAFTRPOPZLAILBN-UHFFFAOYSA-N
MW213.20 g/mol
LogP1.80
Rot. Bonds2

About 2-(furan-2-yl)imidazo[1,2-a]pyrimidine-3-carbaldehyde

2-(furan-2-yl)imidazo[1,2-a]pyrimidine-3-carbaldehyde (PubChem CID 15502894) has the molecular formula C11H7N3O2 and a molecular weight of 213.20 g/mol. Its IUPAC name is 2-(furan-2-yl)imidazo[1,2-a]pyrimidine-3-carbaldehyde.

Molecular Properties

Compound Name2-(furan-2-yl)imidazo[1,2-a]pyrimidine-3-carbaldehyde
PubChem CID15502894
Molecular FormulaC11H7N3O2
Molecular Weight213.20 g/mol
Exact Mass213.05
IUPAC Name2-(furan-2-yl)imidazo[1,2-a]pyrimidine-3-carbaldehyde
SMILESO=Cc1c(-c2ccco2)nc2ncccn12
InChIInChI=1S/C11H7N3O2/c15-7-8-10(9-3-1-6-16-9)13-11-12-4-2-5-14(8)11/h1-7H
InChIKeyAFTRPOPZLAILBN-UHFFFAOYSA-N
XLogP1.80
TPSA60.40 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.20
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze 2-(furan-2-yl)imidazo[1,2-a]pyrimidine-3-carbaldehyde 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-(furan-2-yl)imidazo[1,2-a]pyrimidine-3-carbaldehyde?
The IUPAC name of 2-(furan-2-yl)imidazo[1,2-a]pyrimidine-3-carbaldehyde (CID 15502894) is 2-(furan-2-yl)imidazo[1,2-a]pyrimidine-3-carbaldehyde.
What is the SMILES notation for 2-(furan-2-yl)imidazo[1,2-a]pyrimidine-3-carbaldehyde?
The canonical SMILES for 2-(furan-2-yl)imidazo[1,2-a]pyrimidine-3-carbaldehyde is O=Cc1c(-c2ccco2)nc2ncccn12.
What is the InChIKey of 2-(furan-2-yl)imidazo[1,2-a]pyrimidine-3-carbaldehyde?
The InChIKey is AFTRPOPZLAILBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7N3O2/c15-7-8-10(9-3-1-6-16-9)13-11-12-4-2-5-14(8)11/h1-7H.
What are the key properties of 2-(furan-2-yl)imidazo[1,2-a]pyrimidine-3-carbaldehyde?
2-(furan-2-yl)imidazo[1,2-a]pyrimidine-3-carbaldehyde has a molecular weight of 213.20 g/mol, XLogP of 1.80, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)imidazo[1,2-a]pyrimidine-3-carbaldehyde is sourced from PubChem (CID 15502894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).