2,6-dimethyl-4-[6-(trifluoromethyl)pyrimidin-4-yl]morpholine

C11H14F3N3O — CID 172900300

IUPAC2,6-dimethyl-4-[6-(trifluoromethyl)pyrimidin-4-yl]morpholine
SMILESCC1CN(c2cc(C(F)(F)F)ncn2)CC(C)O1
InChIInChI=1S/C11H14F3N3O/c1-7-4-17(5-8(2)18-7)10-3-9(11(12,13)14)15-6-16-10/h3,6-8H,4-5H2,1-2H3
InChIKeyZIAFQSDLSGMTOE-UHFFFAOYSA-N
MW261.25 g/mol
LogP2.11
Rot. Bonds1

About 2,6-dimethyl-4-[6-(trifluoromethyl)pyrimidin-4-yl]morpholine

2,6-dimethyl-4-[6-(trifluoromethyl)pyrimidin-4-yl]morpholine (PubChem CID 172900300) has the molecular formula C11H14F3N3O and a molecular weight of 261.25 g/mol. Its IUPAC name is 2,6-dimethyl-4-[6-(trifluoromethyl)pyrimidin-4-yl]morpholine.

Molecular Properties

Compound Name2,6-dimethyl-4-[6-(trifluoromethyl)pyrimidin-4-yl]morpholine
PubChem CID172900300
Molecular FormulaC11H14F3N3O
Molecular Weight261.25 g/mol
Exact Mass261.11
IUPAC Name2,6-dimethyl-4-[6-(trifluoromethyl)pyrimidin-4-yl]morpholine
SMILESCC1CN(c2cc(C(F)(F)F)ncn2)CC(C)O1
InChIInChI=1S/C11H14F3N3O/c1-7-4-17(5-8(2)18-7)10-3-9(11(12,13)14)15-6-16-10/h3,6-8H,4-5H2,1-2H3
InChIKeyZIAFQSDLSGMTOE-UHFFFAOYSA-N
XLogP2.11
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.25
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(3aS,6aS)-5-[6-(trifluoromethyl)pyrimidin-4-yl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrole
CID 97377895
(2R,6R)-2,6-dimethyl-4-(6-methylpyrimidin-4-yl)morpholine
CID 42270575
(2S,6R)-2,6-dimethyl-4-[2-(trifluoromethyl)-4-pyridinyl]morpholine
CID 155974206
[4-(2,6-dimethylmorpholin-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine
CID 114567450
3-[6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]pyrimidin-4-yl]cyclobutan-1-ol
CID 91770488
4-(3-methoxypyrrolidin-1-yl)-6-(trifluoromethyl)pyrimidine
CID 126855030
2-cyclopropyl-6-methyl-4-(6-methylpyrimidin-4-yl)morpholine
CID 154779371
4-[3-(difluoromethyl)pyrrolidin-1-yl]-6-(trifluoromethyl)pyrimidine
CID 166602956
methyl 6-[(2S,6S)-2,6-dimethylmorpholin-4-yl]pyrimidine-4-carboxylate
CID 129497950
6-(2,6-dimethylmorpholin-4-yl)-N-propylpyrimidin-4-amine
CID 80764701
N-methyl-1-[6-(trifluoromethyl)pyrimidin-4-yl]pyrrolidine-3-carboxamide
CID 171704924
3-(2,6-dimethylmorpholin-4-yl)-5-(trifluoromethyl)pyridin-2-amine
CID 82022182

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-[6-(trifluoromethyl)pyrimidin-4-yl]morpholine?
The IUPAC name of 2,6-dimethyl-4-[6-(trifluoromethyl)pyrimidin-4-yl]morpholine (CID 172900300) is 2,6-dimethyl-4-[6-(trifluoromethyl)pyrimidin-4-yl]morpholine.
What is the SMILES notation for 2,6-dimethyl-4-[6-(trifluoromethyl)pyrimidin-4-yl]morpholine?
The canonical SMILES for 2,6-dimethyl-4-[6-(trifluoromethyl)pyrimidin-4-yl]morpholine is CC1CN(c2cc(C(F)(F)F)ncn2)CC(C)O1.
What is the InChIKey of 2,6-dimethyl-4-[6-(trifluoromethyl)pyrimidin-4-yl]morpholine?
The InChIKey is ZIAFQSDLSGMTOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F3N3O/c1-7-4-17(5-8(2)18-7)10-3-9(11(12,13)14)15-6-16-10/h3,6-8H,4-5H2,1-2H3.
What are the key properties of 2,6-dimethyl-4-[6-(trifluoromethyl)pyrimidin-4-yl]morpholine?
2,6-dimethyl-4-[6-(trifluoromethyl)pyrimidin-4-yl]morpholine has a molecular weight of 261.25 g/mol, XLogP of 2.11, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-[6-(trifluoromethyl)pyrimidin-4-yl]morpholine is sourced from PubChem (CID 172900300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).