4-(2,2-dimethylmorpholin-4-yl)-6-(trifluoromethyl)pyrimidin-2-amine

C11H15F3N4O — CID 114564196

IUPAC4-(2,2-dimethylmorpholin-4-yl)-6-(trifluoromethyl)pyrimidin-2-amine
SMILESCC1(C)CN(c2cc(C(F)(F)F)nc(N)n2)CCO1
InChIInChI=1S/C11H15F3N4O/c1-10(2)6-18(3-4-19-10)8-5-7(11(12,13)14)16-9(15)17-8/h5H,3-4,6H2,1-2H3,(H2,15,16,17)
InChIKeyWVBHLJMXEWQEKJ-UHFFFAOYSA-N
MW276.26 g/mol
LogP1.69
Rot. Bonds1

About 4-(2,2-dimethylmorpholin-4-yl)-6-(trifluoromethyl)pyrimidin-2-amine

4-(2,2-dimethylmorpholin-4-yl)-6-(trifluoromethyl)pyrimidin-2-amine (PubChem CID 114564196) has the molecular formula C11H15F3N4O and a molecular weight of 276.26 g/mol. Its IUPAC name is 4-(2,2-dimethylmorpholin-4-yl)-6-(trifluoromethyl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-(2,2-dimethylmorpholin-4-yl)-6-(trifluoromethyl)pyrimidin-2-amine
PubChem CID114564196
Molecular FormulaC11H15F3N4O
Molecular Weight276.26 g/mol
Exact Mass276.12
IUPAC Name4-(2,2-dimethylmorpholin-4-yl)-6-(trifluoromethyl)pyrimidin-2-amine
SMILESCC1(C)CN(c2cc(C(F)(F)F)nc(N)n2)CCO1
InChIInChI=1S/C11H15F3N4O/c1-10(2)6-18(3-4-19-10)8-5-7(11(12,13)14)16-9(15)17-8/h5H,3-4,6H2,1-2H3,(H2,15,16,17)
InChIKeyWVBHLJMXEWQEKJ-UHFFFAOYSA-N
XLogP1.69
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.26
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-(2,2-dimethylmorpholin-4-yl)-6-(trifluoromethyl)pyrimidin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(2,2-dimethylmorpholin-4-yl)-6-(trifluoromethyl)pyrimidin-2-amine?
The IUPAC name of 4-(2,2-dimethylmorpholin-4-yl)-6-(trifluoromethyl)pyrimidin-2-amine (CID 114564196) is 4-(2,2-dimethylmorpholin-4-yl)-6-(trifluoromethyl)pyrimidin-2-amine.
What is the SMILES notation for 4-(2,2-dimethylmorpholin-4-yl)-6-(trifluoromethyl)pyrimidin-2-amine?
The canonical SMILES for 4-(2,2-dimethylmorpholin-4-yl)-6-(trifluoromethyl)pyrimidin-2-amine is CC1(C)CN(c2cc(C(F)(F)F)nc(N)n2)CCO1.
What is the InChIKey of 4-(2,2-dimethylmorpholin-4-yl)-6-(trifluoromethyl)pyrimidin-2-amine?
The InChIKey is WVBHLJMXEWQEKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F3N4O/c1-10(2)6-18(3-4-19-10)8-5-7(11(12,13)14)16-9(15)17-8/h5H,3-4,6H2,1-2H3,(H2,15,16,17).
What are the key properties of 4-(2,2-dimethylmorpholin-4-yl)-6-(trifluoromethyl)pyrimidin-2-amine?
4-(2,2-dimethylmorpholin-4-yl)-6-(trifluoromethyl)pyrimidin-2-amine has a molecular weight of 276.26 g/mol, XLogP of 1.69, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-dimethylmorpholin-4-yl)-6-(trifluoromethyl)pyrimidin-2-amine is sourced from PubChem (CID 114564196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).