methyl 3-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]benzoate

C18H17N3O4 — CID 110500306

IUPACmethyl 3-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]benzoate
SMILESCOC(=O)c1cccc(NC(=O)COc2cccn3cc(C)nc23)c1
InChIInChI=1S/C18H17N3O4/c1-12-10-21-8-4-7-15(17(21)19-12)25-11-16(22)20-14-6-3-5-13(9-14)18(23)24-2/h3-10H,11H2,1-2H3,(H,20,22)
InChIKeyFKWNNOHXKCZOPJ-UHFFFAOYSA-N
MW339.35 g/mol
LogP2.45
Rot. Bonds5

About methyl 3-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]benzoate

methyl 3-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]benzoate (PubChem CID 110500306) has the molecular formula C18H17N3O4 and a molecular weight of 339.35 g/mol. Its IUPAC name is methyl 3-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]benzoate.

Molecular Properties

Compound Namemethyl 3-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]benzoate
PubChem CID110500306
Molecular FormulaC18H17N3O4
Molecular Weight339.35 g/mol
Exact Mass339.12
IUPAC Namemethyl 3-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]benzoate
SMILESCOC(=O)c1cccc(NC(=O)COc2cccn3cc(C)nc23)c1
InChIInChI=1S/C18H17N3O4/c1-12-10-21-8-4-7-15(17(21)19-12)25-11-16(22)20-14-6-3-5-13(9-14)18(23)24-2/h3-10H,11H2,1-2H3,(H,20,22)
InChIKeyFKWNNOHXKCZOPJ-UHFFFAOYSA-N
XLogP2.45
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.35
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze methyl 3-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]benzoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]benzene-1,3-dicarboxylic acid
CID 110500173
N-(2,6-dichlorophenyl)-2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetamide
CID 110500214
N-(3-fluoro-4-nitrophenyl)-2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetamide
CID 110500359
N-(2,4-difluorophenyl)-2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetamide
CID 110500320
N-(2-methoxy-5-nitrophenyl)-2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetamide
CID 110500224
2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxy-N-(4-methyl-3-oxo-1,4-benzoxazin-6-yl)acetamide
CID 110500353
2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxy-N-[4-(4-methylpiperidin-1-yl)phenyl]acetamide
CID 110500276
2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxy-N-(2,4,4-trimethylpentan-2-yl)acetamide
CID 110496806
N-[(4-methoxyphenyl)methyl]-2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetamide
CID 110496780
2-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]pentanoic acid
CID 110496809
N-[2-(4-hydroxyphenyl)ethyl]-2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetamide
CID 110496747
N-[(4-chlorophenyl)methyl]-2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetamide
CID 110496827

Frequently Asked Questions

What is the IUPAC name of methyl 3-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]benzoate?
The IUPAC name of methyl 3-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]benzoate (CID 110500306) is methyl 3-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]benzoate.
What is the SMILES notation for methyl 3-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]benzoate?
The canonical SMILES for methyl 3-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]benzoate is COC(=O)c1cccc(NC(=O)COc2cccn3cc(C)nc23)c1.
What is the InChIKey of methyl 3-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]benzoate?
The InChIKey is FKWNNOHXKCZOPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O4/c1-12-10-21-8-4-7-15(17(21)19-12)25-11-16(22)20-14-6-3-5-13(9-14)18(23)24-2/h3-10H,11H2,1-2H3,(H,20,22).
What are the key properties of methyl 3-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]benzoate?
methyl 3-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]benzoate has a molecular weight of 339.35 g/mol, XLogP of 2.45, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 3-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]benzoate is sourced from PubChem (CID 110500306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).