methyl 2-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylate

C10H7F3N2O2 — CID 71671570

IUPACmethyl 2-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylate
SMILESCOC(=O)c1ccc2nc(C(F)(F)F)cn2c1
InChIInChI=1S/C10H7F3N2O2/c1-17-9(16)6-2-3-8-14-7(10(11,12)13)5-15(8)4-6/h2-5H,1H3
InChIKeyRYRYWRGTTHIMLM-UHFFFAOYSA-N
MW244.17 g/mol
LogP2.14
Rot. Bonds1

About methyl 2-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylate

methyl 2-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylate (PubChem CID 71671570) has the molecular formula C10H7F3N2O2 and a molecular weight of 244.17 g/mol. Its IUPAC name is methyl 2-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylate.

Molecular Properties

Compound Namemethyl 2-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylate
PubChem CID71671570
Molecular FormulaC10H7F3N2O2
Molecular Weight244.17 g/mol
Exact Mass244.05
IUPAC Namemethyl 2-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylate
SMILESCOC(=O)c1ccc2nc(C(F)(F)F)cn2c1
InChIInChI=1S/C10H7F3N2O2/c1-17-9(16)6-2-3-8-14-7(10(11,12)13)5-15(8)4-6/h2-5H,1H3
InChIKeyRYRYWRGTTHIMLM-UHFFFAOYSA-N
XLogP2.14
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.17
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of methyl 2-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylate?
The IUPAC name of methyl 2-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylate (CID 71671570) is methyl 2-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylate.
What is the SMILES notation for methyl 2-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylate?
The canonical SMILES for methyl 2-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylate is COC(=O)c1ccc2nc(C(F)(F)F)cn2c1.
What is the InChIKey of methyl 2-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylate?
The InChIKey is RYRYWRGTTHIMLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F3N2O2/c1-17-9(16)6-2-3-8-14-7(10(11,12)13)5-15(8)4-6/h2-5H,1H3.
What are the key properties of methyl 2-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylate?
methyl 2-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylate has a molecular weight of 244.17 g/mol, XLogP of 2.14, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylate is sourced from PubChem (CID 71671570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).