N-ethyl-8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxamide

C14H11F3N4O2 — CID 118378928

IUPACN-ethyl-8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxamide
SMILESCCNC(=O)c1cnc2c(-c3cnco3)cc(C(F)(F)F)cn12
InChIInChI=1S/C14H11F3N4O2/c1-2-19-13(22)10-4-20-12-9(11-5-18-7-23-11)3-8(6-21(10)12)14(15,16)17/h3-7H,2H2,1H3,(H,19,22)
InChIKeyBJTMKJUAFRRYAF-UHFFFAOYSA-N
MW324.26 g/mol
LogP2.76
Rot. Bonds3

About N-ethyl-8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxamide

N-ethyl-8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 118378928) has the molecular formula C14H11F3N4O2 and a molecular weight of 324.26 g/mol. Its IUPAC name is N-ethyl-8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID118378928
Molecular FormulaC14H11F3N4O2
Molecular Weight324.26 g/mol
Exact Mass324.08
IUPAC NameN-ethyl-8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxamide
SMILESCCNC(=O)c1cnc2c(-c3cnco3)cc(C(F)(F)F)cn12
InChIInChI=1S/C14H11F3N4O2/c1-2-19-13(22)10-4-20-12-9(11-5-18-7-23-11)3-8(6-21(10)12)14(15,16)17/h3-7H,2H2,1H3,(H,19,22)
InChIKeyBJTMKJUAFRRYAF-UHFFFAOYSA-N
XLogP2.76
TPSA72.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.26
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-ethyl-8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxamide (CID 118378928) is N-ethyl-8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-ethyl-8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-ethyl-8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxamide is CCNC(=O)c1cnc2c(-c3cnco3)cc(C(F)(F)F)cn12.
What is the InChIKey of N-ethyl-8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is BJTMKJUAFRRYAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F3N4O2/c1-2-19-13(22)10-4-20-12-9(11-5-18-7-23-11)3-8(6-21(10)12)14(15,16)17/h3-7H,2H2,1H3,(H,19,22).
What are the key properties of N-ethyl-8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxamide?
N-ethyl-8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 324.26 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 118378928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).