1-[4-[6-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]piperazin-1-yl]ethanone

C19H18F3N5O — CID 139344703

IUPAC1-[4-[6-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]piperazin-1-yl]ethanone
SMILESCC(=O)N1CCN(c2cccc(-c3cnc4ccc(C(F)(F)F)cn34)n2)CC1
InChIInChI=1S/C19H18F3N5O/c1-13(28)25-7-9-26(10-8-25)18-4-2-3-15(24-18)16-11-23-17-6-5-14(12-27(16)17)19(20,21)22/h2-6,11-12H,7-10H2,1H3
InChIKeyCFNDADQRGFTNJA-UHFFFAOYSA-N
MW389.38 g/mol
LogP3.08
Rot. Bonds2

About 1-[4-[6-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]piperazin-1-yl]ethanone

1-[4-[6-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]piperazin-1-yl]ethanone (PubChem CID 139344703) has the molecular formula C19H18F3N5O and a molecular weight of 389.38 g/mol. Its IUPAC name is 1-[4-[6-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]piperazin-1-yl]ethanone.

Molecular Properties

Compound Name1-[4-[6-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]piperazin-1-yl]ethanone
PubChem CID139344703
Molecular FormulaC19H18F3N5O
Molecular Weight389.38 g/mol
Exact Mass389.15
IUPAC Name1-[4-[6-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]piperazin-1-yl]ethanone
SMILESCC(=O)N1CCN(c2cccc(-c3cnc4ccc(C(F)(F)F)cn34)n2)CC1
InChIInChI=1S/C19H18F3N5O/c1-13(28)25-7-9-26(10-8-25)18-4-2-3-15(24-18)16-11-23-17-6-5-14(12-27(16)17)19(20,21)22/h2-6,11-12H,7-10H2,1H3
InChIKeyCFNDADQRGFTNJA-UHFFFAOYSA-N
XLogP3.08
TPSA53.74 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.38
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

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7-Phenyl-3-(pyridin-4-yl)imidazo[1,2-a]pyridine
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Imidazopyridine 10b
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Imidazopyridine 12a
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Imidazopyridine 12b
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Imidazopyridine 12c
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Frequently Asked Questions

What is the IUPAC name of 1-[4-[6-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]piperazin-1-yl]ethanone?
The IUPAC name of 1-[4-[6-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]piperazin-1-yl]ethanone (CID 139344703) is 1-[4-[6-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]piperazin-1-yl]ethanone.
What is the SMILES notation for 1-[4-[6-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]piperazin-1-yl]ethanone?
The canonical SMILES for 1-[4-[6-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]piperazin-1-yl]ethanone is CC(=O)N1CCN(c2cccc(-c3cnc4ccc(C(F)(F)F)cn34)n2)CC1.
What is the InChIKey of 1-[4-[6-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]piperazin-1-yl]ethanone?
The InChIKey is CFNDADQRGFTNJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18F3N5O/c1-13(28)25-7-9-26(10-8-25)18-4-2-3-15(24-18)16-11-23-17-6-5-14(12-27(16)17)19(20,21)22/h2-6,11-12H,7-10H2,1H3.
What are the key properties of 1-[4-[6-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]piperazin-1-yl]ethanone?
1-[4-[6-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]piperazin-1-yl]ethanone has a molecular weight of 389.38 g/mol, XLogP of 3.08, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[6-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]piperazin-1-yl]ethanone is sourced from PubChem (CID 139344703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).