ethyl 8-carbamoylimidazo[1,2-a]pyridine-2-carboxylate

C11H11N3O3 — CID 143716769

IUPACethyl 8-carbamoylimidazo[1,2-a]pyridine-2-carboxylate
SMILESCCOC(=O)c1cn2cccc(C(N)=O)c2n1
InChIInChI=1S/C11H11N3O3/c1-2-17-11(16)8-6-14-5-3-4-7(9(12)15)10(14)13-8/h3-6H,2H2,1H3,(H2,12,15)
InChIKeyLGIXHRUGZBTBPR-UHFFFAOYSA-N
MW233.23 g/mol
LogP0.61
Rot. Bonds3

About ethyl 8-carbamoylimidazo[1,2-a]pyridine-2-carboxylate

ethyl 8-carbamoylimidazo[1,2-a]pyridine-2-carboxylate (PubChem CID 143716769) has the molecular formula C11H11N3O3 and a molecular weight of 233.23 g/mol. Its IUPAC name is ethyl 8-carbamoylimidazo[1,2-a]pyridine-2-carboxylate.

Molecular Properties

Compound Nameethyl 8-carbamoylimidazo[1,2-a]pyridine-2-carboxylate
PubChem CID143716769
Molecular FormulaC11H11N3O3
Molecular Weight233.23 g/mol
Exact Mass233.08
IUPAC Nameethyl 8-carbamoylimidazo[1,2-a]pyridine-2-carboxylate
SMILESCCOC(=O)c1cn2cccc(C(N)=O)c2n1
InChIInChI=1S/C11H11N3O3/c1-2-17-11(16)8-6-14-5-3-4-7(9(12)15)10(14)13-8/h3-6H,2H2,1H3,(H2,12,15)
InChIKeyLGIXHRUGZBTBPR-UHFFFAOYSA-N
XLogP0.61
TPSA86.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.23
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 8-bromoimidazo[1,2-a]pyridine-2-carboxylate
CID 57360969
ethyl 8-(chloromethyl)imidazo[1,2-a]pyridine-2-carboxylate
CID 19701330
CID 70300240
CID 70300240
ethyl pyrrolo[2,1-c][1,2,4]triazine-3-carboxylate
CID 170452736
ethyl 2-(dichloromethyl)imidazo[1,2-a]pyridine-8-carboxylate
CID 59280012
ethyl 2-phenylimidazo[1,2-a]pyridine-8-carboxylate;hydrobromide
CID 67768891
ethyl 2-[(2-methylimidazo[1,2-a]pyridine-8-carbonyl)amino]benzoate
CID 110704737
ethyl 2-(4-formylphenyl)imidazo[1,2-a]pyridine-8-carboxylate
CID 58208423
ethyl 2-[4-(difluoromethyl)phenyl]imidazo[1,2-a]pyridine-8-carboxylate
CID 58208449
ethyl tetrazolo[1,5-a]pyridine-8-carboxylate
CID 102030693
ethyl 6,8-dichloroimidazo[1,2-a]pyridine-2-carboxylate;hydrobromide
CID 90484321
ethyl 6-amino-8-chloroimidazo[1,2-a]pyridine-2-carboxylate
CID 131365721

Frequently Asked Questions

What is the IUPAC name of ethyl 8-carbamoylimidazo[1,2-a]pyridine-2-carboxylate?
The IUPAC name of ethyl 8-carbamoylimidazo[1,2-a]pyridine-2-carboxylate (CID 143716769) is ethyl 8-carbamoylimidazo[1,2-a]pyridine-2-carboxylate.
What is the SMILES notation for ethyl 8-carbamoylimidazo[1,2-a]pyridine-2-carboxylate?
The canonical SMILES for ethyl 8-carbamoylimidazo[1,2-a]pyridine-2-carboxylate is CCOC(=O)c1cn2cccc(C(N)=O)c2n1.
What is the InChIKey of ethyl 8-carbamoylimidazo[1,2-a]pyridine-2-carboxylate?
The InChIKey is LGIXHRUGZBTBPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O3/c1-2-17-11(16)8-6-14-5-3-4-7(9(12)15)10(14)13-8/h3-6H,2H2,1H3,(H2,12,15).
What are the key properties of ethyl 8-carbamoylimidazo[1,2-a]pyridine-2-carboxylate?
ethyl 8-carbamoylimidazo[1,2-a]pyridine-2-carboxylate has a molecular weight of 233.23 g/mol, XLogP of 0.61, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 8-carbamoylimidazo[1,2-a]pyridine-2-carboxylate is sourced from PubChem (CID 143716769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).