ethyl 2-(trifluoromethyl)imidazo[1,2-a]pyrazine-3-carboxylate

C10H8F3N3O2 — CID 135393426

IUPACethyl 2-(trifluoromethyl)imidazo[1,2-a]pyrazine-3-carboxylate
SMILESCCOC(=O)c1c(C(F)(F)F)nc2cnccn12
InChIInChI=1S/C10H8F3N3O2/c1-2-18-9(17)7-8(10(11,12)13)15-6-5-14-3-4-16(6)7/h3-5H,2H2,1H3
InChIKeyNMFFRSQMULAJHG-UHFFFAOYSA-N
MW259.19 g/mol
LogP1.92
Rot. Bonds2

About ethyl 2-(trifluoromethyl)imidazo[1,2-a]pyrazine-3-carboxylate

ethyl 2-(trifluoromethyl)imidazo[1,2-a]pyrazine-3-carboxylate (PubChem CID 135393426) has the molecular formula C10H8F3N3O2 and a molecular weight of 259.19 g/mol. Its IUPAC name is ethyl 2-(trifluoromethyl)imidazo[1,2-a]pyrazine-3-carboxylate.

Molecular Properties

Compound Nameethyl 2-(trifluoromethyl)imidazo[1,2-a]pyrazine-3-carboxylate
PubChem CID135393426
Molecular FormulaC10H8F3N3O2
Molecular Weight259.19 g/mol
Exact Mass259.06
IUPAC Nameethyl 2-(trifluoromethyl)imidazo[1,2-a]pyrazine-3-carboxylate
SMILESCCOC(=O)c1c(C(F)(F)F)nc2cnccn12
InChIInChI=1S/C10H8F3N3O2/c1-2-18-9(17)7-8(10(11,12)13)15-6-5-14-3-4-16(6)7/h3-5H,2H2,1H3
InChIKeyNMFFRSQMULAJHG-UHFFFAOYSA-N
XLogP1.92
TPSA56.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.19
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-(trifluoromethyl)imidazo[1,2-a]pyrazine-3-carboxylate?
The IUPAC name of ethyl 2-(trifluoromethyl)imidazo[1,2-a]pyrazine-3-carboxylate (CID 135393426) is ethyl 2-(trifluoromethyl)imidazo[1,2-a]pyrazine-3-carboxylate.
What is the SMILES notation for ethyl 2-(trifluoromethyl)imidazo[1,2-a]pyrazine-3-carboxylate?
The canonical SMILES for ethyl 2-(trifluoromethyl)imidazo[1,2-a]pyrazine-3-carboxylate is CCOC(=O)c1c(C(F)(F)F)nc2cnccn12.
What is the InChIKey of ethyl 2-(trifluoromethyl)imidazo[1,2-a]pyrazine-3-carboxylate?
The InChIKey is NMFFRSQMULAJHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F3N3O2/c1-2-18-9(17)7-8(10(11,12)13)15-6-5-14-3-4-16(6)7/h3-5H,2H2,1H3.
What are the key properties of ethyl 2-(trifluoromethyl)imidazo[1,2-a]pyrazine-3-carboxylate?
ethyl 2-(trifluoromethyl)imidazo[1,2-a]pyrazine-3-carboxylate has a molecular weight of 259.19 g/mol, XLogP of 1.92, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(trifluoromethyl)imidazo[1,2-a]pyrazine-3-carboxylate is sourced from PubChem (CID 135393426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).