methyl 8-aminoimidazo[1,2-a]pyridine-3-carboxylate

C9H9N3O2 — CID 131336795

IUPACmethyl 8-aminoimidazo[1,2-a]pyridine-3-carboxylate
SMILESCOC(=O)c1cnc2c(N)cccn12
InChIInChI=1S/C9H9N3O2/c1-14-9(13)7-5-11-8-6(10)3-2-4-12(7)8/h2-5H,10H2,1H3
InChIKeyUAACSHAZHBJILV-UHFFFAOYSA-N
MW191.19 g/mol
LogP0.70
Rot. Bonds1

About methyl 8-aminoimidazo[1,2-a]pyridine-3-carboxylate

methyl 8-aminoimidazo[1,2-a]pyridine-3-carboxylate (PubChem CID 131336795) has the molecular formula C9H9N3O2 and a molecular weight of 191.19 g/mol. Its IUPAC name is methyl 8-aminoimidazo[1,2-a]pyridine-3-carboxylate.

Molecular Properties

Compound Namemethyl 8-aminoimidazo[1,2-a]pyridine-3-carboxylate
PubChem CID131336795
Molecular FormulaC9H9N3O2
Molecular Weight191.19 g/mol
Exact Mass191.07
IUPAC Namemethyl 8-aminoimidazo[1,2-a]pyridine-3-carboxylate
SMILESCOC(=O)c1cnc2c(N)cccn12
InChIInChI=1S/C9H9N3O2/c1-14-9(13)7-5-11-8-6(10)3-2-4-12(7)8/h2-5H,10H2,1H3
InChIKeyUAACSHAZHBJILV-UHFFFAOYSA-N
XLogP0.70
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze methyl 8-aminoimidazo[1,2-a]pyridine-3-carboxylate 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

ethyl 8-ethoxyimidazo[1,2-a]pyridine-3-carboxylate
CID 90090238
3-ethoxycarbonylimidazo[1,2-a]pyridine-8-carboxylic acid
CID 59588419
2-(9-amino-4-oxopyrido[1,2-a]pyrimidin-3-yl)acetic acid
CID 115031157
ethyl 8-tert-butylimidazo[1,2-a]pyridine-3-carboxylate
CID 166563440
ethyl 8-chloroimidazo[1,2-a]pyridine-3-carboxylate;sulfuric acid
CID 91757252
methyl 3-(aminomethyl)imidazo[1,2-a]pyridine-8-carboxylate
CID 117256872
N,8-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 143716928
8-amino-N-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 178051545
methyl 3-(methylsulfonylmethyl)imidazo[1,2-a]pyridine-8-carboxylate
CID 117256887
methyl 3-ethenylimidazo[1,2-a]pyridine-8-carboxylate
CID 135146869
dimethyl 1-(2-aminobenzoyl)pyrazole-3,5-dicarboxylate
CID 13290788
8-tert-butylimidazo[1,2-a]pyridine-3-carboxylic acid
CID 166563458

Frequently Asked Questions

What is the IUPAC name of methyl 8-aminoimidazo[1,2-a]pyridine-3-carboxylate?
The IUPAC name of methyl 8-aminoimidazo[1,2-a]pyridine-3-carboxylate (CID 131336795) is methyl 8-aminoimidazo[1,2-a]pyridine-3-carboxylate.
What is the SMILES notation for methyl 8-aminoimidazo[1,2-a]pyridine-3-carboxylate?
The canonical SMILES for methyl 8-aminoimidazo[1,2-a]pyridine-3-carboxylate is COC(=O)c1cnc2c(N)cccn12.
What is the InChIKey of methyl 8-aminoimidazo[1,2-a]pyridine-3-carboxylate?
The InChIKey is UAACSHAZHBJILV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O2/c1-14-9(13)7-5-11-8-6(10)3-2-4-12(7)8/h2-5H,10H2,1H3.
What are the key properties of methyl 8-aminoimidazo[1,2-a]pyridine-3-carboxylate?
methyl 8-aminoimidazo[1,2-a]pyridine-3-carboxylate has a molecular weight of 191.19 g/mol, XLogP of 0.70, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 8-aminoimidazo[1,2-a]pyridine-3-carboxylate is sourced from PubChem (CID 131336795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).