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

C11H14F3N3O — CID 119103561

IUPAC2,6-dimethyl-4-[4-(trifluoromethyl)pyrimidin-2-yl]morpholine
SMILESCC1CN(c2nccc(C(F)(F)F)n2)CC(C)O1
InChIInChI=1S/C11H14F3N3O/c1-7-5-17(6-8(2)18-7)10-15-4-3-9(16-10)11(12,13)14/h3-4,7-8H,5-6H2,1-2H3
InChIKeyVDXRCEMEBLLVDX-UHFFFAOYSA-N
MW261.25 g/mol
LogP2.11
Rot. Bonds1

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

2,6-dimethyl-4-[4-(trifluoromethyl)pyrimidin-2-yl]morpholine (PubChem CID 119103561) has the molecular formula C11H14F3N3O and a molecular weight of 261.25 g/mol. Its IUPAC name is 2,6-dimethyl-4-[4-(trifluoromethyl)pyrimidin-2-yl]morpholine.

Molecular Properties

Compound Name2,6-dimethyl-4-[4-(trifluoromethyl)pyrimidin-2-yl]morpholine
PubChem CID119103561
Molecular FormulaC11H14F3N3O
Molecular Weight261.25 g/mol
Exact Mass261.11
IUPAC Name2,6-dimethyl-4-[4-(trifluoromethyl)pyrimidin-2-yl]morpholine
SMILESCC1CN(c2nccc(C(F)(F)F)n2)CC(C)O1
InChIInChI=1S/C11H14F3N3O/c1-7-5-17(6-8(2)18-7)10-15-4-3-9(16-10)11(12,13)14/h3-4,7-8H,5-6H2,1-2H3
InChIKeyVDXRCEMEBLLVDX-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

N,N-dimethyl-4-(trifluoromethyl)pyrimidin-2-amine
CID 10750222
2-(Piperidin-4-yloxy)-4-(trifluoromethyl)pyrimidine
CID 23133612
N-[(4-ethylmorpholin-2-yl)methyl]-4-(trifluoromethyl)pyrimidin-2-amine
CID 53592753
2-Pyrrolidin-3-yloxy-4-(trifluoromethyl)pyrimidine
CID 64585868
4-Methyl-2-[3-(2-piperidin-1-ylethoxy)pyrrolidin-1-yl]pyrimidine
CID 75432365
4-Methyl-3-(4-methylpyrimidin-2-yl)morpholine
CID 110269460
2-(2-Piperazin-1-ylethoxy)-4-(trifluoromethyl)pyrimidine
CID 172434778
2-[(1,4-Dimethylpiperazin-2-yl)methoxy]-4-(trifluoromethyl)pyrimidine
CID 172437603
1-(4-(Trifluoromethyl)pyrimidin-2-yl)piperidin-4-ol
CID 2795837
2,6-Dimethyl-4-(6-methylpyrimidin-4-YL)morpholine hydrochloride
CID 16876387
2-(4-Isopropylpiperazin-1-yl)-4-(trifluoromethyl)pyrimidine
CID 20613837
2-Methoxy-4-(trifluoromethyl)pyrimidine
CID 15074801

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-[4-(trifluoromethyl)pyrimidin-2-yl]morpholine?
The IUPAC name of 2,6-dimethyl-4-[4-(trifluoromethyl)pyrimidin-2-yl]morpholine (CID 119103561) is 2,6-dimethyl-4-[4-(trifluoromethyl)pyrimidin-2-yl]morpholine.
What is the SMILES notation for 2,6-dimethyl-4-[4-(trifluoromethyl)pyrimidin-2-yl]morpholine?
The canonical SMILES for 2,6-dimethyl-4-[4-(trifluoromethyl)pyrimidin-2-yl]morpholine is CC1CN(c2nccc(C(F)(F)F)n2)CC(C)O1.
What is the InChIKey of 2,6-dimethyl-4-[4-(trifluoromethyl)pyrimidin-2-yl]morpholine?
The InChIKey is VDXRCEMEBLLVDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F3N3O/c1-7-5-17(6-8(2)18-7)10-15-4-3-9(16-10)11(12,13)14/h3-4,7-8H,5-6H2,1-2H3.
What are the key properties of 2,6-dimethyl-4-[4-(trifluoromethyl)pyrimidin-2-yl]morpholine?
2,6-dimethyl-4-[4-(trifluoromethyl)pyrimidin-2-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-[4-(trifluoromethyl)pyrimidin-2-yl]morpholine is sourced from PubChem (CID 119103561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).