2-[7-ethoxy-2-[(1S)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone

C92H96F12N12O12 — CID 164983190

IUPAC2-[7-ethoxy-2-[(1S)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone
SMILESCCOc1cc2nc(C(C)[C@H]3CCOC3)cn2cc1CC(=O)c1cccc(C(F)(F)F)n1.CCOc1cc2nc([C@@H](C)[C@@H]3CCOC3)cn2cc1CC(=O)c1cccc(C(F)(F)F)n1.CCOc1cc2nc([C@H](C)[C@@H]3CCOC3)cn2cc1CC(=O)c1cccc(C(F)(F)F)n1.CCOc1cc2nc([C@H](C)[C@H]3CCOC3)cn2cc1CC(=O)c1cccc(C(F)(F)F)n1
InChIInChI=1S/4C23H24F3N3O3/c4*1-3-32-20-10-22-28-18(14(2)15-7-8-31-13-15)12-29(22)11-16(20)9-19(30)17-5-4-6-21(27-17)23(24,25)26/h4*4-6,10-12,14-15H,3,7-9,13H2,1-2H3/t14?,15-;2*14-,15+;14-,15-/m0101/s1
InChIKeyFUBGPLTWILCOPE-CZTVWADGSA-N
MW1789.83 g/mol
LogP18.85
Rot. Bonds28

About 2-[7-ethoxy-2-[(1S)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone

2-[7-ethoxy-2-[(1S)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone (PubChem CID 164983190) has the molecular formula C92H96F12N12O12 and a molecular weight of 1789.83 g/mol. Its IUPAC name is 2-[7-ethoxy-2-[(1S)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone.

Molecular Properties

Compound Name2-[7-ethoxy-2-[(1S)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone
PubChem CID164983190
Molecular FormulaC92H96F12N12O12
Molecular Weight1789.83 g/mol
Exact Mass1788.71
IUPAC Name2-[7-ethoxy-2-[(1S)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone
SMILESCCOc1cc2nc(C(C)[C@H]3CCOC3)cn2cc1CC(=O)c1cccc(C(F)(F)F)n1.CCOc1cc2nc([C@@H](C)[C@@H]3CCOC3)cn2cc1CC(=O)c1cccc(C(F)(F)F)n1.CCOc1cc2nc([C@H](C)[C@@H]3CCOC3)cn2cc1CC(=O)c1cccc(C(F)(F)F)n1.CCOc1cc2nc([C@H](C)[C@H]3CCOC3)cn2cc1CC(=O)c1cccc(C(F)(F)F)n1
InChIInChI=1S/4C23H24F3N3O3/c4*1-3-32-20-10-22-28-18(14(2)15-7-8-31-13-15)12-29(22)11-16(20)9-19(30)17-5-4-6-21(27-17)23(24,25)26/h4*4-6,10-12,14-15H,3,7-9,13H2,1-2H3/t14?,15-;2*14-,15+;14-,15-/m0101/s1
InChIKeyFUBGPLTWILCOPE-CZTVWADGSA-N
XLogP18.85
TPSA262.88 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds28
Heavy Atoms128
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001789.83
LogP ≤ 518.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Analyze 2-[7-ethoxy-2-[(1S)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[7-ethoxy-2-[(1S)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone?
The IUPAC name of 2-[7-ethoxy-2-[(1S)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone (CID 164983190) is 2-[7-ethoxy-2-[(1S)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone.
What is the SMILES notation for 2-[7-ethoxy-2-[(1S)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone?
The canonical SMILES for 2-[7-ethoxy-2-[(1S)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone is CCOc1cc2nc(C(C)[C@H]3CCOC3)cn2cc1CC(=O)c1cccc(C(F)(F)F)n1.CCOc1cc2nc([C@@H](C)[C@@H]3CCOC3)cn2cc1CC(=O)c1cccc(C(F)(F)F)n1.CCOc1cc2nc([C@H](C)[C@@H]3CCOC3)cn2cc1CC(=O)c1cccc(C(F)(F)F)n1.CCOc1cc2nc([C@H](C)[C@H]3CCOC3)cn2cc1CC(=O)c1cccc(C(F)(F)F)n1.
What is the InChIKey of 2-[7-ethoxy-2-[(1S)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone?
The InChIKey is FUBGPLTWILCOPE-CZTVWADGSA-N. The full InChI is InChI=1S/4C23H24F3N3O3/c4*1-3-32-20-10-22-28-18(14(2)15-7-8-31-13-15)12-29(22)11-16(20)9-19(30)17-5-4-6-21(27-17)23(24,25)26/h4*4-6,10-12,14-15H,3,7-9,13H2,1-2H3/t14?,15-;2*14-,15+;14-,15-/m0101/s1.
What are the key properties of 2-[7-ethoxy-2-[(1S)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone?
2-[7-ethoxy-2-[(1S)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone has a molecular weight of 1789.83 g/mol, XLogP of 18.85, 28 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[7-ethoxy-2-[(1S)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[(1R)-1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone;2-[7-ethoxy-2-[1-[(3R)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridin-6-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone is sourced from PubChem (CID 164983190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).