3-[[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]imidazo[1,2-a]pyrazine

C16H17F3N6 — CID 129001837

IUPAC3-[[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]imidazo[1,2-a]pyrazine
SMILESFC(F)(F)c1cnc(C2CCCN(Cc3cnc4cnccn34)C2)[nH]1
InChIInChI=1S/C16H17F3N6/c17-16(18,19)13-7-22-15(23-13)11-2-1-4-24(9-11)10-12-6-21-14-8-20-3-5-25(12)14/h3,5-8,11H,1-2,4,9-10H2,(H,22,23)
InChIKeyQYFUNBFVAALUIA-UHFFFAOYSA-N
MW350.35 g/mol
LogP2.85
Rot. Bonds3

About 3-[[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]imidazo[1,2-a]pyrazine

3-[[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]imidazo[1,2-a]pyrazine (PubChem CID 129001837) has the molecular formula C16H17F3N6 and a molecular weight of 350.35 g/mol. Its IUPAC name is 3-[[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name3-[[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]imidazo[1,2-a]pyrazine
PubChem CID129001837
Molecular FormulaC16H17F3N6
Molecular Weight350.35 g/mol
Exact Mass350.15
IUPAC Name3-[[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]imidazo[1,2-a]pyrazine
SMILESFC(F)(F)c1cnc(C2CCCN(Cc3cnc4cnccn34)C2)[nH]1
InChIInChI=1S/C16H17F3N6/c17-16(18,19)13-7-22-15(23-13)11-2-1-4-24(9-11)10-12-6-21-14-8-20-3-5-25(12)14/h3,5-8,11H,1-2,4,9-10H2,(H,22,23)
InChIKeyQYFUNBFVAALUIA-UHFFFAOYSA-N
XLogP2.85
TPSA62.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.35
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-[[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]imidazo[1,2-a]pyrazine with MolForge

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Related Compounds

4-[[(3R)-3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]pyridin-2-amine
CID 124889899
2-[[(3S)-3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]benzonitrile
CID 100670291
2-[[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]benzonitrile
CID 128963917
3-[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]propanoic acid
CID 120581560
2-cyclopentyl-5-(trifluoromethyl)-1H-imidazole
CID 71204532
2-fluoro-4-[[(3S)-3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]benzonitrile
CID 100670320
3-[[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]pyridine
CID 71999804
(3-ethyl-4-pyridinyl)-[(3R)-3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methanone
CID 129346899
(3-fluoro-4-pyridinyl)-[(3S)-3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methanone
CID 129479643
(3-chloro-4-pyridinyl)-[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methanone
CID 128996043
3-[[4-[(4-fluorophenyl)methoxy]piperidin-1-yl]methyl]imidazo[1,2-a]pyrazine
CID 86785208
1-ethyl-4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidine
CID 167890054

Frequently Asked Questions

What is the IUPAC name of 3-[[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]imidazo[1,2-a]pyrazine?
The IUPAC name of 3-[[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]imidazo[1,2-a]pyrazine (CID 129001837) is 3-[[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]imidazo[1,2-a]pyrazine.
What is the SMILES notation for 3-[[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]imidazo[1,2-a]pyrazine?
The canonical SMILES for 3-[[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]imidazo[1,2-a]pyrazine is FC(F)(F)c1cnc(C2CCCN(Cc3cnc4cnccn34)C2)[nH]1.
What is the InChIKey of 3-[[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]imidazo[1,2-a]pyrazine?
The InChIKey is QYFUNBFVAALUIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17F3N6/c17-16(18,19)13-7-22-15(23-13)11-2-1-4-24(9-11)10-12-6-21-14-8-20-3-5-25(12)14/h3,5-8,11H,1-2,4,9-10H2,(H,22,23).
What are the key properties of 3-[[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]imidazo[1,2-a]pyrazine?
3-[[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]imidazo[1,2-a]pyrazine has a molecular weight of 350.35 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]imidazo[1,2-a]pyrazine is sourced from PubChem (CID 129001837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).