[4-[6-(methylamino)-2-(trifluoromethyl)pyrimidin-4-yl]morpholin-2-yl]methanol

C11H15F3N4O2 — CID 106772601

IUPAC[4-[6-(methylamino)-2-(trifluoromethyl)pyrimidin-4-yl]morpholin-2-yl]methanol
SMILESCNc1cc(N2CCOC(CO)C2)nc(C(F)(F)F)n1
InChIInChI=1S/C11H15F3N4O2/c1-15-8-4-9(17-10(16-8)11(12,13)14)18-2-3-20-7(5-18)6-19/h4,7,19H,2-3,5-6H2,1H3,(H,15,16,17)
InChIKeyDVKZSKIUEVAMFJ-UHFFFAOYSA-N
MW292.26 g/mol
LogP0.73
Rot. Bonds3

About [4-[6-(methylamino)-2-(trifluoromethyl)pyrimidin-4-yl]morpholin-2-yl]methanol

[4-[6-(methylamino)-2-(trifluoromethyl)pyrimidin-4-yl]morpholin-2-yl]methanol (PubChem CID 106772601) has the molecular formula C11H15F3N4O2 and a molecular weight of 292.26 g/mol. Its IUPAC name is [4-[6-(methylamino)-2-(trifluoromethyl)pyrimidin-4-yl]morpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[6-(methylamino)-2-(trifluoromethyl)pyrimidin-4-yl]morpholin-2-yl]methanol
PubChem CID106772601
Molecular FormulaC11H15F3N4O2
Molecular Weight292.26 g/mol
Exact Mass292.11
IUPAC Name[4-[6-(methylamino)-2-(trifluoromethyl)pyrimidin-4-yl]morpholin-2-yl]methanol
SMILESCNc1cc(N2CCOC(CO)C2)nc(C(F)(F)F)n1
InChIInChI=1S/C11H15F3N4O2/c1-15-8-4-9(17-10(16-8)11(12,13)14)18-2-3-20-7(5-18)6-19/h4,7,19H,2-3,5-6H2,1H3,(H,15,16,17)
InChIKeyDVKZSKIUEVAMFJ-UHFFFAOYSA-N
XLogP0.73
TPSA70.51 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.26
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [4-[6-(methylamino)-2-(trifluoromethyl)pyrimidin-4-yl]morpholin-2-yl]methanol?
The IUPAC name of [4-[6-(methylamino)-2-(trifluoromethyl)pyrimidin-4-yl]morpholin-2-yl]methanol (CID 106772601) is [4-[6-(methylamino)-2-(trifluoromethyl)pyrimidin-4-yl]morpholin-2-yl]methanol.
What is the SMILES notation for [4-[6-(methylamino)-2-(trifluoromethyl)pyrimidin-4-yl]morpholin-2-yl]methanol?
The canonical SMILES for [4-[6-(methylamino)-2-(trifluoromethyl)pyrimidin-4-yl]morpholin-2-yl]methanol is CNc1cc(N2CCOC(CO)C2)nc(C(F)(F)F)n1.
What is the InChIKey of [4-[6-(methylamino)-2-(trifluoromethyl)pyrimidin-4-yl]morpholin-2-yl]methanol?
The InChIKey is DVKZSKIUEVAMFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F3N4O2/c1-15-8-4-9(17-10(16-8)11(12,13)14)18-2-3-20-7(5-18)6-19/h4,7,19H,2-3,5-6H2,1H3,(H,15,16,17).
What are the key properties of [4-[6-(methylamino)-2-(trifluoromethyl)pyrimidin-4-yl]morpholin-2-yl]methanol?
[4-[6-(methylamino)-2-(trifluoromethyl)pyrimidin-4-yl]morpholin-2-yl]methanol has a molecular weight of 292.26 g/mol, XLogP of 0.73, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[6-(methylamino)-2-(trifluoromethyl)pyrimidin-4-yl]morpholin-2-yl]methanol is sourced from PubChem (CID 106772601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).