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

C19H24F3N5O — CID 133484128

IUPAC2-cyclohexyloxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine
SMILESFC(F)(F)c1cnc(C2CCN(c3cncc(OC4CCCCC4)n3)CC2)[nH]1
InChIInChI=1S/C19H24F3N5O/c20-19(21,22)15-10-24-18(25-15)13-6-8-27(9-7-13)16-11-23-12-17(26-16)28-14-4-2-1-3-5-14/h10-14H,1-9H2,(H,24,25)
InChIKeyFCOHQKSUJMWFMI-UHFFFAOYSA-N
MW395.43 g/mol
LogP4.31
Rot. Bonds4

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

2-cyclohexyloxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine (PubChem CID 133484128) has the molecular formula C19H24F3N5O and a molecular weight of 395.43 g/mol. Its IUPAC name is 2-cyclohexyloxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine.

Molecular Properties

Compound Name2-cyclohexyloxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine
PubChem CID133484128
Molecular FormulaC19H24F3N5O
Molecular Weight395.43 g/mol
Exact Mass395.19
IUPAC Name2-cyclohexyloxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine
SMILESFC(F)(F)c1cnc(C2CCN(c3cncc(OC4CCCCC4)n3)CC2)[nH]1
InChIInChI=1S/C19H24F3N5O/c20-19(21,22)15-10-24-18(25-15)13-6-8-27(9-7-13)16-11-23-12-17(26-16)28-14-4-2-1-3-5-14/h10-14H,1-9H2,(H,24,25)
InChIKeyFCOHQKSUJMWFMI-UHFFFAOYSA-N
XLogP4.31
TPSA66.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.43
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyloxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine?
The IUPAC name of 2-cyclohexyloxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine (CID 133484128) is 2-cyclohexyloxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine.
What is the SMILES notation for 2-cyclohexyloxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine?
The canonical SMILES for 2-cyclohexyloxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine is FC(F)(F)c1cnc(C2CCN(c3cncc(OC4CCCCC4)n3)CC2)[nH]1.
What is the InChIKey of 2-cyclohexyloxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine?
The InChIKey is FCOHQKSUJMWFMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24F3N5O/c20-19(21,22)15-10-24-18(25-15)13-6-8-27(9-7-13)16-11-23-12-17(26-16)28-14-4-2-1-3-5-14/h10-14H,1-9H2,(H,24,25).
What are the key properties of 2-cyclohexyloxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine?
2-cyclohexyloxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine has a molecular weight of 395.43 g/mol, XLogP of 4.31, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyloxy-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyrazine is sourced from PubChem (CID 133484128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).