ethyl 7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxylate

C14H14N4O2 — CID 130229964

IUPACethyl 7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxylate
SMILESCCOC(=O)c1cnc2cc(-c3cnn(C)c3)ccn12
InChIInChI=1S/C14H14N4O2/c1-3-20-14(19)12-8-15-13-6-10(4-5-18(12)13)11-7-16-17(2)9-11/h4-9H,3H2,1-2H3
InChIKeyURLPTQMFZKNFFQ-UHFFFAOYSA-N
MW270.29 g/mol
LogP1.91
Rot. Bonds3

About ethyl 7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxylate

ethyl 7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxylate (PubChem CID 130229964) has the molecular formula C14H14N4O2 and a molecular weight of 270.29 g/mol. Its IUPAC name is ethyl 7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxylate.

Molecular Properties

Compound Nameethyl 7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxylate
PubChem CID130229964
Molecular FormulaC14H14N4O2
Molecular Weight270.29 g/mol
Exact Mass270.11
IUPAC Nameethyl 7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxylate
SMILESCCOC(=O)c1cnc2cc(-c3cnn(C)c3)ccn12
InChIInChI=1S/C14H14N4O2/c1-3-20-14(19)12-8-15-13-6-10(4-5-18(12)13)11-7-16-17(2)9-11/h4-9H,3H2,1-2H3
InChIKeyURLPTQMFZKNFFQ-UHFFFAOYSA-N
XLogP1.91
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

ethyl 7-fluoroimidazo[1,2-a]pyridine-3-carboxylate
CID 67259301
ethyl 7-pyrrolidin-1-ylimidazo[1,2-a]pyridine-3-carboxylate
CID 145001485
3-iodo-7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine
CID 154973002
ethyl 7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxylate;methanol
CID 178051371
ethyl 7-ethyl-3-(1-methylpyrazol-4-yl)indolizine-2-carboxylate
CID 71173992
ethyl 6-iodoimidazo[1,2-a]pyridine-3-carboxylate
CID 69203579
3-(3,5-dichlorophenyl)-7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine
CID 164930853
ethane;ethyl 7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate
CID 178093156
ethyl 7-[2-(3,4-dimethylpiperazin-1-yl)ethoxy]imidazo[1,2-a]pyridine-3-carboxylate
CID 123846928
7-(2,2-difluoroethoxy)imidazo[1,2-a]pyridine-3-carboxylic acid;ethyl 7-(2,2-difluoroethoxy)imidazo[1,2-a]pyridine-3-carboxylate
CID 161088998
ethyl 7-[3-(4-fluoro-4-methylpiperidin-1-yl)propoxy]imidazo[1,2-a]pyridine-3-carboxylate
CID 178051681
ethyl 1-(3-bromophenyl)-4-(1-methylpyrazol-4-yl)pyrazole-3-carboxylate
CID 122522198

Frequently Asked Questions

What is the IUPAC name of ethyl 7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxylate?
The IUPAC name of ethyl 7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxylate (CID 130229964) is ethyl 7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxylate.
What is the SMILES notation for ethyl 7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxylate?
The canonical SMILES for ethyl 7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxylate is CCOC(=O)c1cnc2cc(-c3cnn(C)c3)ccn12.
What is the InChIKey of ethyl 7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxylate?
The InChIKey is URLPTQMFZKNFFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O2/c1-3-20-14(19)12-8-15-13-6-10(4-5-18(12)13)11-7-16-17(2)9-11/h4-9H,3H2,1-2H3.
What are the key properties of ethyl 7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxylate?
ethyl 7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxylate has a molecular weight of 270.29 g/mol, XLogP of 1.91, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxylate is sourced from PubChem (CID 130229964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).