8-methyl-2-[4-(oxiran-2-ylmethoxy)phenyl]imidazo[1,2-a]pyridine

C17H16N2O2 — CID 22015632

IUPAC8-methyl-2-[4-(oxiran-2-ylmethoxy)phenyl]imidazo[1,2-a]pyridine
SMILESCc1cccn2cc(-c3ccc(OCC4CO4)cc3)nc12
InChIInChI=1S/C17H16N2O2/c1-12-3-2-8-19-9-16(18-17(12)19)13-4-6-14(7-5-13)20-10-15-11-21-15/h2-9,15H,10-11H2,1H3
InChIKeyNULUVZHFUZAUHD-UHFFFAOYSA-N
MW280.33 g/mol
LogP3.09
Rot. Bonds4

About 8-methyl-2-[4-(oxiran-2-ylmethoxy)phenyl]imidazo[1,2-a]pyridine

8-methyl-2-[4-(oxiran-2-ylmethoxy)phenyl]imidazo[1,2-a]pyridine (PubChem CID 22015632) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is 8-methyl-2-[4-(oxiran-2-ylmethoxy)phenyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name8-methyl-2-[4-(oxiran-2-ylmethoxy)phenyl]imidazo[1,2-a]pyridine
PubChem CID22015632
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC Name8-methyl-2-[4-(oxiran-2-ylmethoxy)phenyl]imidazo[1,2-a]pyridine
SMILESCc1cccn2cc(-c3ccc(OCC4CO4)cc3)nc12
InChIInChI=1S/C17H16N2O2/c1-12-3-2-8-19-9-16(18-17(12)19)13-4-6-14(7-5-13)20-10-15-11-21-15/h2-9,15H,10-11H2,1H3
InChIKeyNULUVZHFUZAUHD-UHFFFAOYSA-N
XLogP3.09
TPSA39.06 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Analyze 8-methyl-2-[4-(oxiran-2-ylmethoxy)phenyl]imidazo[1,2-a]pyridine 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 8-methyl-2-[4-(oxiran-2-ylmethoxy)phenyl]imidazo[1,2-a]pyridine?
The IUPAC name of 8-methyl-2-[4-(oxiran-2-ylmethoxy)phenyl]imidazo[1,2-a]pyridine (CID 22015632) is 8-methyl-2-[4-(oxiran-2-ylmethoxy)phenyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 8-methyl-2-[4-(oxiran-2-ylmethoxy)phenyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 8-methyl-2-[4-(oxiran-2-ylmethoxy)phenyl]imidazo[1,2-a]pyridine is Cc1cccn2cc(-c3ccc(OCC4CO4)cc3)nc12.
What is the InChIKey of 8-methyl-2-[4-(oxiran-2-ylmethoxy)phenyl]imidazo[1,2-a]pyridine?
The InChIKey is NULUVZHFUZAUHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c1-12-3-2-8-19-9-16(18-17(12)19)13-4-6-14(7-5-13)20-10-15-11-21-15/h2-9,15H,10-11H2,1H3.
What are the key properties of 8-methyl-2-[4-(oxiran-2-ylmethoxy)phenyl]imidazo[1,2-a]pyridine?
8-methyl-2-[4-(oxiran-2-ylmethoxy)phenyl]imidazo[1,2-a]pyridine has a molecular weight of 280.33 g/mol, XLogP of 3.09, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-2-[4-(oxiran-2-ylmethoxy)phenyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 22015632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).