4-[8-[4-[[6-(trifluoromethyl)-3-pyridinyl]methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine

C25H27F3N4O2 — CID 157339164

IUPAC4-[8-[4-[[6-(trifluoromethyl)-3-pyridinyl]methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine
SMILESFC(F)(F)c1ccc(CC2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)cn1
InChIInChI=1S/C25H27F3N4O2/c26-25(27,28)23-6-3-18(16-31-23)13-17-1-4-20(5-2-17)34-22-15-19(32-9-11-33-12-10-32)14-21-24(22)30-8-7-29-21/h3,6-8,14-17,20H,1-2,4-5,9-13H2
InChIKeyBNAVRIGISCSOSA-UHFFFAOYSA-N
MW472.51 g/mol
LogP5.06
Rot. Bonds5

About 4-[8-[4-[[6-(trifluoromethyl)-3-pyridinyl]methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine

4-[8-[4-[[6-(trifluoromethyl)-3-pyridinyl]methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine (PubChem CID 157339164) has the molecular formula C25H27F3N4O2 and a molecular weight of 472.51 g/mol. Its IUPAC name is 4-[8-[4-[[6-(trifluoromethyl)-3-pyridinyl]methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine.

Molecular Properties

Compound Name4-[8-[4-[[6-(trifluoromethyl)-3-pyridinyl]methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine
PubChem CID157339164
Molecular FormulaC25H27F3N4O2
Molecular Weight472.51 g/mol
Exact Mass472.21
IUPAC Name4-[8-[4-[[6-(trifluoromethyl)-3-pyridinyl]methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine
SMILESFC(F)(F)c1ccc(CC2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)cn1
InChIInChI=1S/C25H27F3N4O2/c26-25(27,28)23-6-3-18(16-31-23)13-17-1-4-20(5-2-17)34-22-15-19(32-9-11-33-12-10-32)14-21-24(22)30-8-7-29-21/h3,6-8,14-17,20H,1-2,4-5,9-13H2
InChIKeyBNAVRIGISCSOSA-UHFFFAOYSA-N
XLogP5.06
TPSA60.37 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500472.51
LogP ≤ 55.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-[8-[4-[[6-(trifluoromethyl)-3-pyridinyl]methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine with MolForge

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Related Compounds

4-[8-[4-[(2-methylpyrimidin-5-yl)methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine
CID 158858413
N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-6-(trifluoromethyl)pyridin-3-amine
CID 121335931
2-[5-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]methyl]pyrimidin-2-yl]propan-2-ol
CID 161213116
4-[8-[4-[(2-chloropyrimidin-4-yl)methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine
CID 157161500
4-[8-[4-[[5-(2-piperidin-1-ylethyl)pyrimidin-2-yl]methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine;4-[8-[4-[[5-(2-pyrrolidin-1-ylethyl)pyrimidin-2-yl]methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine;4-[8-[4-[[5-(trifluoromethyl)-3-pyridinyl]methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine;4-[8-[4-[[2-(trifluoromethyl)pyrimidin-5-yl]methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine
CID 157409001
4-[8-[4-[(2,5-dimethylpyrimidin-4-yl)methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine
CID 158204207
4-[8-[4-[(2-methoxy-3-pyridinyl)methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine
CID 159654436
N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-2-(trifluoromethyl)pyrimidin-5-amine
CID 121335789
N,N-dimethyl-2-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]methyl]pyrimidin-4-amine
CID 147864127
N-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]methyl]acetamide
CID 121335573
5-ethyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-2-amine
CID 90454078
5-ethyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-2-carboxamide
CID 90443960

Frequently Asked Questions

What is the IUPAC name of 4-[8-[4-[[6-(trifluoromethyl)-3-pyridinyl]methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine?
The IUPAC name of 4-[8-[4-[[6-(trifluoromethyl)-3-pyridinyl]methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine (CID 157339164) is 4-[8-[4-[[6-(trifluoromethyl)-3-pyridinyl]methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine.
What is the SMILES notation for 4-[8-[4-[[6-(trifluoromethyl)-3-pyridinyl]methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine?
The canonical SMILES for 4-[8-[4-[[6-(trifluoromethyl)-3-pyridinyl]methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine is FC(F)(F)c1ccc(CC2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)cn1.
What is the InChIKey of 4-[8-[4-[[6-(trifluoromethyl)-3-pyridinyl]methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine?
The InChIKey is BNAVRIGISCSOSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27F3N4O2/c26-25(27,28)23-6-3-18(16-31-23)13-17-1-4-20(5-2-17)34-22-15-19(32-9-11-33-12-10-32)14-21-24(22)30-8-7-29-21/h3,6-8,14-17,20H,1-2,4-5,9-13H2.
What are the key properties of 4-[8-[4-[[6-(trifluoromethyl)-3-pyridinyl]methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine?
4-[8-[4-[[6-(trifluoromethyl)-3-pyridinyl]methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine has a molecular weight of 472.51 g/mol, XLogP of 5.06, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[8-[4-[[6-(trifluoromethyl)-3-pyridinyl]methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine is sourced from PubChem (CID 157339164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).