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

C12H17F3N4O — CID 106771626

IUPAC2-(trifluoromethyl)-6-(2,2,6-trimethylmorpholin-4-yl)pyrimidin-4-amine
SMILESCC1CN(c2cc(N)nc(C(F)(F)F)n2)CC(C)(C)O1
InChIInChI=1S/C12H17F3N4O/c1-7-5-19(6-11(2,3)20-7)9-4-8(16)17-10(18-9)12(13,14)15/h4,7H,5-6H2,1-3H3,(H2,16,17,18)
InChIKeyHNLPQEGLGUETDY-UHFFFAOYSA-N
MW290.29 g/mol
LogP2.08
Rot. Bonds1

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

2-(trifluoromethyl)-6-(2,2,6-trimethylmorpholin-4-yl)pyrimidin-4-amine (PubChem CID 106771626) has the molecular formula C12H17F3N4O and a molecular weight of 290.29 g/mol. Its IUPAC name is 2-(trifluoromethyl)-6-(2,2,6-trimethylmorpholin-4-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-(trifluoromethyl)-6-(2,2,6-trimethylmorpholin-4-yl)pyrimidin-4-amine
PubChem CID106771626
Molecular FormulaC12H17F3N4O
Molecular Weight290.29 g/mol
Exact Mass290.14
IUPAC Name2-(trifluoromethyl)-6-(2,2,6-trimethylmorpholin-4-yl)pyrimidin-4-amine
SMILESCC1CN(c2cc(N)nc(C(F)(F)F)n2)CC(C)(C)O1
InChIInChI=1S/C12H17F3N4O/c1-7-5-19(6-11(2,3)20-7)9-4-8(16)17-10(18-9)12(13,14)15/h4,7H,5-6H2,1-3H3,(H2,16,17,18)
InChIKeyHNLPQEGLGUETDY-UHFFFAOYSA-N
XLogP2.08
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.29
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methylsulfanyl-6-(2,2,6-trimethylmorpholin-4-yl)pyrimidin-4-amine
CID 80816748
6-(3,4-dimethylpiperidin-1-yl)-2-(trifluoromethyl)pyrimidin-4-amine
CID 106773226
6-pyrrolidin-1-yl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106770242
4-N-ethyl-6-(2,2,6-trimethylmorpholin-4-yl)pyrimidine-2,4-diamine
CID 80816046
1-[6-amino-2-(trifluoromethyl)pyrimidin-4-yl]pyrrolidin-3-ol
CID 106771825
4-[6-chloro-2-(trifluoromethyl)pyrimidin-4-yl]-2,2,6,6-tetramethylmorpholine
CID 106768492
6-(7,7-dimethyl-1,4-thiazepan-4-yl)-2-(trifluoromethyl)pyrimidin-4-amine
CID 107460198
4-(6-chloro-2-pyridinyl)-2,2,6-trimethylmorpholine
CID 63588228
[6-(2,2,6-trimethylmorpholin-4-yl)-2-pyridinyl]methanamine
CID 62284830
6-(3,3-dimethylmorpholin-4-yl)-2-(trifluoromethyl)pyrimidin-4-amine
CID 106771089
[6-(2,2,6-trimethylmorpholin-4-yl)pyrazin-2-yl]methanamine
CID 66451628
6-(3-propylpyrrolidin-1-yl)-2-(trifluoromethyl)pyrimidin-4-amine
CID 106772949

Frequently Asked Questions

What is the IUPAC name of 2-(trifluoromethyl)-6-(2,2,6-trimethylmorpholin-4-yl)pyrimidin-4-amine?
The IUPAC name of 2-(trifluoromethyl)-6-(2,2,6-trimethylmorpholin-4-yl)pyrimidin-4-amine (CID 106771626) is 2-(trifluoromethyl)-6-(2,2,6-trimethylmorpholin-4-yl)pyrimidin-4-amine.
What is the SMILES notation for 2-(trifluoromethyl)-6-(2,2,6-trimethylmorpholin-4-yl)pyrimidin-4-amine?
The canonical SMILES for 2-(trifluoromethyl)-6-(2,2,6-trimethylmorpholin-4-yl)pyrimidin-4-amine is CC1CN(c2cc(N)nc(C(F)(F)F)n2)CC(C)(C)O1.
What is the InChIKey of 2-(trifluoromethyl)-6-(2,2,6-trimethylmorpholin-4-yl)pyrimidin-4-amine?
The InChIKey is HNLPQEGLGUETDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17F3N4O/c1-7-5-19(6-11(2,3)20-7)9-4-8(16)17-10(18-9)12(13,14)15/h4,7H,5-6H2,1-3H3,(H2,16,17,18).
What are the key properties of 2-(trifluoromethyl)-6-(2,2,6-trimethylmorpholin-4-yl)pyrimidin-4-amine?
2-(trifluoromethyl)-6-(2,2,6-trimethylmorpholin-4-yl)pyrimidin-4-amine has a molecular weight of 290.29 g/mol, XLogP of 2.08, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trifluoromethyl)-6-(2,2,6-trimethylmorpholin-4-yl)pyrimidin-4-amine is sourced from PubChem (CID 106771626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).