N-[4-(trifluoromethyl)pyrimidin-2-yl]morpholin-4-amine

C9H11F3N4O — CID 83026552

IUPACN-[4-(trifluoromethyl)pyrimidin-2-yl]morpholin-4-amine
SMILESFC(F)(F)c1ccnc(NN2CCOCC2)n1
InChIInChI=1S/C9H11F3N4O/c10-9(11,12)7-1-2-13-8(14-7)15-16-3-5-17-6-4-16/h1-2H,3-6H2,(H,13,14,15)
InChIKeyYPWPHSOQTVNGLX-UHFFFAOYSA-N
MW248.21 g/mol
LogP1.15
Rot. Bonds2

About N-[4-(trifluoromethyl)pyrimidin-2-yl]morpholin-4-amine

N-[4-(trifluoromethyl)pyrimidin-2-yl]morpholin-4-amine (PubChem CID 83026552) has the molecular formula C9H11F3N4O and a molecular weight of 248.21 g/mol. Its IUPAC name is N-[4-(trifluoromethyl)pyrimidin-2-yl]morpholin-4-amine.

Molecular Properties

Compound NameN-[4-(trifluoromethyl)pyrimidin-2-yl]morpholin-4-amine
PubChem CID83026552
Molecular FormulaC9H11F3N4O
Molecular Weight248.21 g/mol
Exact Mass248.09
IUPAC NameN-[4-(trifluoromethyl)pyrimidin-2-yl]morpholin-4-amine
SMILESFC(F)(F)c1ccnc(NN2CCOCC2)n1
InChIInChI=1S/C9H11F3N4O/c10-9(11,12)7-1-2-13-8(14-7)15-16-3-5-17-6-4-16/h1-2H,3-6H2,(H,13,14,15)
InChIKeyYPWPHSOQTVNGLX-UHFFFAOYSA-N
XLogP1.15
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.21
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[4-(trifluoromethyl)pyrimidin-2-yl]morpholin-4-amine with MolForge

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

Launch Full Analysis

Related Compounds

N-piperidin-1-yl-4-(trifluoromethyl)pyrimidin-2-amine
CID 113221365
N-[1-(oxolan-3-yl)piperidin-4-yl]-4-(trifluoromethyl)pyrimidin-2-amine
CID 133381110
N-[[(2R)-4-methylmorpholin-2-yl]methyl]-4-(trifluoromethyl)pyrimidin-2-amine
CID 95160947
4-N-morpholin-4-yl-2-N-propyl-6-(trifluoromethyl)pyrimidine-2,4-diamine
CID 114565646
N-(2-methylpyrimidin-4-yl)morpholin-4-amine
CID 83025498
N-[[(2S)-4-cyclopropylmorpholin-2-yl]methyl]-4-(trifluoromethyl)pyrimidin-2-amine
CID 95305722
N-[5-(trifluoromethyl)-2-pyridinyl]morpholin-4-amine
CID 78908037
4-morpholin-4-yl-N-[1-[4-(trifluoromethyl)pyrimidin-2-yl]pyrrolidin-3-yl]pyrimidin-2-amine
CID 171994408
3-[2-[[4-(trifluoromethyl)pyrimidin-2-yl]amino]ethyl]-1,3-oxazolidin-2-one
CID 56860108
N-propan-2-yl-4-(trifluoromethyl)pyrimidin-2-amine
CID 2796113
N-butan-2-yl-4-(trifluoromethyl)pyrimidin-2-amine
CID 60732408
N-[3-methyl-5-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]-4-(trifluoromethyl)pyrimidin-2-amine
CID 71075508

Frequently Asked Questions

What is the IUPAC name of N-[4-(trifluoromethyl)pyrimidin-2-yl]morpholin-4-amine?
The IUPAC name of N-[4-(trifluoromethyl)pyrimidin-2-yl]morpholin-4-amine (CID 83026552) is N-[4-(trifluoromethyl)pyrimidin-2-yl]morpholin-4-amine.
What is the SMILES notation for N-[4-(trifluoromethyl)pyrimidin-2-yl]morpholin-4-amine?
The canonical SMILES for N-[4-(trifluoromethyl)pyrimidin-2-yl]morpholin-4-amine is FC(F)(F)c1ccnc(NN2CCOCC2)n1.
What is the InChIKey of N-[4-(trifluoromethyl)pyrimidin-2-yl]morpholin-4-amine?
The InChIKey is YPWPHSOQTVNGLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F3N4O/c10-9(11,12)7-1-2-13-8(14-7)15-16-3-5-17-6-4-16/h1-2H,3-6H2,(H,13,14,15).
What are the key properties of N-[4-(trifluoromethyl)pyrimidin-2-yl]morpholin-4-amine?
N-[4-(trifluoromethyl)pyrimidin-2-yl]morpholin-4-amine has a molecular weight of 248.21 g/mol, XLogP of 1.15, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(trifluoromethyl)pyrimidin-2-yl]morpholin-4-amine is sourced from PubChem (CID 83026552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).