2-ethoxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine

C15H18F3N5O — CID 75383896

IUPAC2-ethoxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine
SMILESCCOc1cncc(N2CCC(c3ncc(C(F)(F)F)[nH]3)CC2)n1
InChIInChI=1S/C15H18F3N5O/c1-2-24-13-9-19-8-12(22-13)23-5-3-10(4-6-23)14-20-7-11(21-14)15(16,17)18/h7-10H,2-6H2,1H3,(H,20,21)
InChIKeyUUXZNKYBDLMHSX-UHFFFAOYSA-N
MW341.34 g/mol
LogP3.00
Rot. Bonds4

About 2-ethoxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine

2-ethoxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine (PubChem CID 75383896) has the molecular formula C15H18F3N5O and a molecular weight of 341.34 g/mol. Its IUPAC name is 2-ethoxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine.

Molecular Properties

Compound Name2-ethoxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine
PubChem CID75383896
Molecular FormulaC15H18F3N5O
Molecular Weight341.34 g/mol
Exact Mass341.15
IUPAC Name2-ethoxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine
SMILESCCOc1cncc(N2CCC(c3ncc(C(F)(F)F)[nH]3)CC2)n1
InChIInChI=1S/C15H18F3N5O/c1-2-24-13-9-19-8-12(22-13)23-5-3-10(4-6-23)14-20-7-11(21-14)15(16,17)18/h7-10H,2-6H2,1H3,(H,20,21)
InChIKeyUUXZNKYBDLMHSX-UHFFFAOYSA-N
XLogP3.00
TPSA66.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.34
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-4-[2-[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]ethyl]morpholine
CID 121537123
(2R)-2-methyl-4-[2-[(3R)-3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]ethyl]morpholine
CID 124733897
(2R)-2-methyl-4-[2-[(3S)-3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]ethyl]morpholine
CID 124733898
(2S)-2-methyl-4-[2-[(3R)-3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]ethyl]morpholine
CID 124733899
(2S)-2-methyl-4-[2-[(3S)-3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]ethyl]morpholine
CID 124733900
2-Ethoxy-6-[3-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]piperidin-1-yl]pyrazine
CID 128977590
2-ethoxy-6-[(3R)-3-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]piperidin-1-yl]pyrazine
CID 129534326
2-ethoxy-6-[(3S)-3-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]piperidin-1-yl]pyrazine
CID 129534328
2-(cyclopentylmethoxy)-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine
CID 133484123
2-propan-2-yloxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine
CID 133484127
2-cyclohexyloxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine
CID 133484128
2-methoxy-3-[[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]pyrazine
CID 137991442

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine?
The IUPAC name of 2-ethoxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine (CID 75383896) is 2-ethoxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine.
What is the SMILES notation for 2-ethoxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine?
The canonical SMILES for 2-ethoxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine is CCOc1cncc(N2CCC(c3ncc(C(F)(F)F)[nH]3)CC2)n1.
What is the InChIKey of 2-ethoxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine?
The InChIKey is UUXZNKYBDLMHSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18F3N5O/c1-2-24-13-9-19-8-12(22-13)23-5-3-10(4-6-23)14-20-7-11(21-14)15(16,17)18/h7-10H,2-6H2,1H3,(H,20,21).
What are the key properties of 2-ethoxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine?
2-ethoxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine has a molecular weight of 341.34 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine is sourced from PubChem (CID 75383896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).