4-(2,5,6-trifluoropyrimidin-4-yl)morpholine

C8H8F3N3O — CID 46910334

IUPAC4-(2,5,6-trifluoropyrimidin-4-yl)morpholine
SMILESFc1nc(F)c(F)c(N2CCOCC2)n1
InChIInChI=1S/C8H8F3N3O/c9-5-6(10)12-8(11)13-7(5)14-1-3-15-4-2-14/h1-4H2
InChIKeyNXWUKDPLGGSUPC-UHFFFAOYSA-N
MW219.17 g/mol
LogP0.73
Rot. Bonds1

About 4-(2,5,6-trifluoropyrimidin-4-yl)morpholine

4-(2,5,6-trifluoropyrimidin-4-yl)morpholine (PubChem CID 46910334) has the molecular formula C8H8F3N3O and a molecular weight of 219.17 g/mol. Its IUPAC name is 4-(2,5,6-trifluoropyrimidin-4-yl)morpholine.

Molecular Properties

Compound Name4-(2,5,6-trifluoropyrimidin-4-yl)morpholine
PubChem CID46910334
Molecular FormulaC8H8F3N3O
Molecular Weight219.17 g/mol
Exact Mass219.06
IUPAC Name4-(2,5,6-trifluoropyrimidin-4-yl)morpholine
SMILESFc1nc(F)c(F)c(N2CCOCC2)n1
InChIInChI=1S/C8H8F3N3O/c9-5-6(10)12-8(11)13-7(5)14-1-3-15-4-2-14/h1-4H2
InChIKeyNXWUKDPLGGSUPC-UHFFFAOYSA-N
XLogP0.73
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.17
LogP ≤ 50.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2,5,6-trifluoropyrimidin-4-yl)morpholine?
The IUPAC name of 4-(2,5,6-trifluoropyrimidin-4-yl)morpholine (CID 46910334) is 4-(2,5,6-trifluoropyrimidin-4-yl)morpholine.
What is the SMILES notation for 4-(2,5,6-trifluoropyrimidin-4-yl)morpholine?
The canonical SMILES for 4-(2,5,6-trifluoropyrimidin-4-yl)morpholine is Fc1nc(F)c(F)c(N2CCOCC2)n1.
What is the InChIKey of 4-(2,5,6-trifluoropyrimidin-4-yl)morpholine?
The InChIKey is NXWUKDPLGGSUPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F3N3O/c9-5-6(10)12-8(11)13-7(5)14-1-3-15-4-2-14/h1-4H2.
What are the key properties of 4-(2,5,6-trifluoropyrimidin-4-yl)morpholine?
4-(2,5,6-trifluoropyrimidin-4-yl)morpholine has a molecular weight of 219.17 g/mol, XLogP of 0.73, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5,6-trifluoropyrimidin-4-yl)morpholine is sourced from PubChem (CID 46910334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).