methyl 3-benzyl-2-propylimidazo[1,2-a]pyridine-6-carboxylate

C19H20N2O2 — CID 51359030

IUPACmethyl 3-benzyl-2-propylimidazo[1,2-a]pyridine-6-carboxylate
SMILESCCCc1nc2ccc(C(=O)OC)cn2c1Cc1ccccc1
InChIInChI=1S/C19H20N2O2/c1-3-7-16-17(12-14-8-5-4-6-9-14)21-13-15(19(22)23-2)10-11-18(21)20-16/h4-6,8-11,13H,3,7,12H2,1-2H3
InChIKeyRWGXZZUIYKBYSG-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.66
Rot. Bonds5

About methyl 3-benzyl-2-propylimidazo[1,2-a]pyridine-6-carboxylate

methyl 3-benzyl-2-propylimidazo[1,2-a]pyridine-6-carboxylate (PubChem CID 51359030) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is methyl 3-benzyl-2-propylimidazo[1,2-a]pyridine-6-carboxylate.

Molecular Properties

Compound Namemethyl 3-benzyl-2-propylimidazo[1,2-a]pyridine-6-carboxylate
PubChem CID51359030
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC Namemethyl 3-benzyl-2-propylimidazo[1,2-a]pyridine-6-carboxylate
SMILESCCCc1nc2ccc(C(=O)OC)cn2c1Cc1ccccc1
InChIInChI=1S/C19H20N2O2/c1-3-7-16-17(12-14-8-5-4-6-9-14)21-13-15(19(22)23-2)10-11-18(21)20-16/h4-6,8-11,13H,3,7,12H2,1-2H3
InChIKeyRWGXZZUIYKBYSG-UHFFFAOYSA-N
XLogP3.66
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze methyl 3-benzyl-2-propylimidazo[1,2-a]pyridine-6-carboxylate 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 methyl 3-benzyl-2-propylimidazo[1,2-a]pyridine-6-carboxylate?
The IUPAC name of methyl 3-benzyl-2-propylimidazo[1,2-a]pyridine-6-carboxylate (CID 51359030) is methyl 3-benzyl-2-propylimidazo[1,2-a]pyridine-6-carboxylate.
What is the SMILES notation for methyl 3-benzyl-2-propylimidazo[1,2-a]pyridine-6-carboxylate?
The canonical SMILES for methyl 3-benzyl-2-propylimidazo[1,2-a]pyridine-6-carboxylate is CCCc1nc2ccc(C(=O)OC)cn2c1Cc1ccccc1.
What is the InChIKey of methyl 3-benzyl-2-propylimidazo[1,2-a]pyridine-6-carboxylate?
The InChIKey is RWGXZZUIYKBYSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-3-7-16-17(12-14-8-5-4-6-9-14)21-13-15(19(22)23-2)10-11-18(21)20-16/h4-6,8-11,13H,3,7,12H2,1-2H3.
What are the key properties of methyl 3-benzyl-2-propylimidazo[1,2-a]pyridine-6-carboxylate?
methyl 3-benzyl-2-propylimidazo[1,2-a]pyridine-6-carboxylate has a molecular weight of 308.38 g/mol, XLogP of 3.66, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 3-benzyl-2-propylimidazo[1,2-a]pyridine-6-carboxylate is sourced from PubChem (CID 51359030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).