imidazo[1,2-a]pyridin-2-ylmethyl quinoxaline-2-carboxylate

C17H12N4O2 — CID 71944439

IUPACimidazo[1,2-a]pyridin-2-ylmethyl quinoxaline-2-carboxylate
SMILESO=C(OCc1cn2ccccc2n1)c1cnc2ccccc2n1
InChIInChI=1S/C17H12N4O2/c22-17(15-9-18-13-5-1-2-6-14(13)20-15)23-11-12-10-21-8-4-3-7-16(21)19-12/h1-10H,11H2
InChIKeyFMHIIVGPJMUWMW-UHFFFAOYSA-N
MW304.31 g/mol
LogP2.63
Rot. Bonds3

About imidazo[1,2-a]pyridin-2-ylmethyl quinoxaline-2-carboxylate

imidazo[1,2-a]pyridin-2-ylmethyl quinoxaline-2-carboxylate (PubChem CID 71944439) has the molecular formula C17H12N4O2 and a molecular weight of 304.31 g/mol. Its IUPAC name is imidazo[1,2-a]pyridin-2-ylmethyl quinoxaline-2-carboxylate.

Molecular Properties

Compound Nameimidazo[1,2-a]pyridin-2-ylmethyl quinoxaline-2-carboxylate
PubChem CID71944439
Molecular FormulaC17H12N4O2
Molecular Weight304.31 g/mol
Exact Mass304.10
IUPAC Nameimidazo[1,2-a]pyridin-2-ylmethyl quinoxaline-2-carboxylate
SMILESO=C(OCc1cn2ccccc2n1)c1cnc2ccccc2n1
InChIInChI=1S/C17H12N4O2/c22-17(15-9-18-13-5-1-2-6-14(13)20-15)23-11-12-10-21-8-4-3-7-16(21)19-12/h1-10H,11H2
InChIKeyFMHIIVGPJMUWMW-UHFFFAOYSA-N
XLogP2.63
TPSA69.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.31
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

imidazo[1,2-a]pyridin-2-ylmethyl 4-aminobenzoate
CID 60655585
imidazo[1,2-a]pyridin-2-ylmethyl 2-amino-5-fluorobenzoate
CID 60656851
2-O-ethyl 4-O-(imidazo[1,2-a]pyridin-2-ylmethyl) 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate
CID 7173028
imidazo[1,2-a]pyridin-2-ylmethyl 2-amino-4-chlorobenzoate
CID 60656920
imidazo[1,2-a]pyridin-2-ylmethyl 4-(methylsulfonylmethyl)benzoate
CID 7625039
imidazo[1,2-a]pyridin-2-ylmethyl 1-amino-9,10-dioxoanthracene-2-carboxylate
CID 55372410
2-(phenoxymethyl)imidazo[1,2-a]pyridine
CID 4702052
imidazo[1,2-a]pyridin-2-ylmethyl 2-piperidin-1-ylsulfonylbenzoate
CID 7626180
imidazo[1,2-a]pyridin-2-ylmethyl 3-fluoro-4-methoxybenzoate
CID 7523277
ethyl 3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoate
CID 112788039
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoate
CID 7063876
imidazo[1,2-a]pyridin-2-ylmethyl 2-(2-hydroxyethylamino)-5-nitrobenzoate
CID 7983275

Frequently Asked Questions

What is the IUPAC name of imidazo[1,2-a]pyridin-2-ylmethyl quinoxaline-2-carboxylate?
The IUPAC name of imidazo[1,2-a]pyridin-2-ylmethyl quinoxaline-2-carboxylate (CID 71944439) is imidazo[1,2-a]pyridin-2-ylmethyl quinoxaline-2-carboxylate.
What is the SMILES notation for imidazo[1,2-a]pyridin-2-ylmethyl quinoxaline-2-carboxylate?
The canonical SMILES for imidazo[1,2-a]pyridin-2-ylmethyl quinoxaline-2-carboxylate is O=C(OCc1cn2ccccc2n1)c1cnc2ccccc2n1.
What is the InChIKey of imidazo[1,2-a]pyridin-2-ylmethyl quinoxaline-2-carboxylate?
The InChIKey is FMHIIVGPJMUWMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N4O2/c22-17(15-9-18-13-5-1-2-6-14(13)20-15)23-11-12-10-21-8-4-3-7-16(21)19-12/h1-10H,11H2.
What are the key properties of imidazo[1,2-a]pyridin-2-ylmethyl quinoxaline-2-carboxylate?
imidazo[1,2-a]pyridin-2-ylmethyl quinoxaline-2-carboxylate has a molecular weight of 304.31 g/mol, XLogP of 2.63, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for imidazo[1,2-a]pyridin-2-ylmethyl quinoxaline-2-carboxylate is sourced from PubChem (CID 71944439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).