4-[2-[[6-methyl-4-(trifluoromethyl)-2-pyridinyl]oxy]ethyl]morpholine

C13H17F3N2O2 — CID 23380593

IUPAC4-[2-[[6-methyl-4-(trifluoromethyl)-2-pyridinyl]oxy]ethyl]morpholine
SMILESCc1cc(C(F)(F)F)cc(OCCN2CCOCC2)n1
InChIInChI=1S/C13H17F3N2O2/c1-10-8-11(13(14,15)16)9-12(17-10)20-7-4-18-2-5-19-6-3-18/h8-9H,2-7H2,1H3
InChIKeyYXNYSXUIGCOTTD-UHFFFAOYSA-N
MW290.28 g/mol
LogP2.12
Rot. Bonds4

About 4-[2-[[6-methyl-4-(trifluoromethyl)-2-pyridinyl]oxy]ethyl]morpholine

4-[2-[[6-methyl-4-(trifluoromethyl)-2-pyridinyl]oxy]ethyl]morpholine (PubChem CID 23380593) has the molecular formula C13H17F3N2O2 and a molecular weight of 290.28 g/mol. Its IUPAC name is 4-[2-[[6-methyl-4-(trifluoromethyl)-2-pyridinyl]oxy]ethyl]morpholine.

Molecular Properties

Compound Name4-[2-[[6-methyl-4-(trifluoromethyl)-2-pyridinyl]oxy]ethyl]morpholine
PubChem CID23380593
Molecular FormulaC13H17F3N2O2
Molecular Weight290.28 g/mol
Exact Mass290.12
IUPAC Name4-[2-[[6-methyl-4-(trifluoromethyl)-2-pyridinyl]oxy]ethyl]morpholine
SMILESCc1cc(C(F)(F)F)cc(OCCN2CCOCC2)n1
InChIInChI=1S/C13H17F3N2O2/c1-10-8-11(13(14,15)16)9-12(17-10)20-7-4-18-2-5-19-6-3-18/h8-9H,2-7H2,1H3
InChIKeyYXNYSXUIGCOTTD-UHFFFAOYSA-N
XLogP2.12
TPSA34.59 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.28
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[2-[[6-methyl-4-(trifluoromethyl)-2-pyridinyl]oxy]ethyl]morpholine?
The IUPAC name of 4-[2-[[6-methyl-4-(trifluoromethyl)-2-pyridinyl]oxy]ethyl]morpholine (CID 23380593) is 4-[2-[[6-methyl-4-(trifluoromethyl)-2-pyridinyl]oxy]ethyl]morpholine.
What is the SMILES notation for 4-[2-[[6-methyl-4-(trifluoromethyl)-2-pyridinyl]oxy]ethyl]morpholine?
The canonical SMILES for 4-[2-[[6-methyl-4-(trifluoromethyl)-2-pyridinyl]oxy]ethyl]morpholine is Cc1cc(C(F)(F)F)cc(OCCN2CCOCC2)n1.
What is the InChIKey of 4-[2-[[6-methyl-4-(trifluoromethyl)-2-pyridinyl]oxy]ethyl]morpholine?
The InChIKey is YXNYSXUIGCOTTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17F3N2O2/c1-10-8-11(13(14,15)16)9-12(17-10)20-7-4-18-2-5-19-6-3-18/h8-9H,2-7H2,1H3.
What are the key properties of 4-[2-[[6-methyl-4-(trifluoromethyl)-2-pyridinyl]oxy]ethyl]morpholine?
4-[2-[[6-methyl-4-(trifluoromethyl)-2-pyridinyl]oxy]ethyl]morpholine has a molecular weight of 290.28 g/mol, XLogP of 2.12, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[[6-methyl-4-(trifluoromethyl)-2-pyridinyl]oxy]ethyl]morpholine is sourced from PubChem (CID 23380593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).