2-[[4-ethyl-6-(trifluoromethyl)pyrimidin-2-yl]-methylamino]ethanol

C10H14F3N3O — CID 10467229

IUPAC2-[[4-ethyl-6-(trifluoromethyl)pyrimidin-2-yl]-methylamino]ethanol
SMILESCCc1cc(C(F)(F)F)nc(N(C)CCO)n1
InChIInChI=1S/C10H14F3N3O/c1-3-7-6-8(10(11,12)13)15-9(14-7)16(2)4-5-17/h6,17H,3-5H2,1-2H3
InChIKeyRSBSKCQCLXRCLI-UHFFFAOYSA-N
MW249.24 g/mol
LogP1.49
Rot. Bonds4

About 2-[[4-ethyl-6-(trifluoromethyl)pyrimidin-2-yl]-methylamino]ethanol

2-[[4-ethyl-6-(trifluoromethyl)pyrimidin-2-yl]-methylamino]ethanol (PubChem CID 10467229) has the molecular formula C10H14F3N3O and a molecular weight of 249.24 g/mol. Its IUPAC name is 2-[[4-ethyl-6-(trifluoromethyl)pyrimidin-2-yl]-methylamino]ethanol.

Molecular Properties

Compound Name2-[[4-ethyl-6-(trifluoromethyl)pyrimidin-2-yl]-methylamino]ethanol
PubChem CID10467229
Molecular FormulaC10H14F3N3O
Molecular Weight249.24 g/mol
Exact Mass249.11
IUPAC Name2-[[4-ethyl-6-(trifluoromethyl)pyrimidin-2-yl]-methylamino]ethanol
SMILESCCc1cc(C(F)(F)F)nc(N(C)CCO)n1
InChIInChI=1S/C10H14F3N3O/c1-3-7-6-8(10(11,12)13)15-9(14-7)16(2)4-5-17/h6,17H,3-5H2,1-2H3
InChIKeyRSBSKCQCLXRCLI-UHFFFAOYSA-N
XLogP1.49
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.24
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[[4-ethyl-6-(trifluoromethyl)pyrimidin-2-yl]-methylamino]ethanol 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 2-[[4-ethyl-6-(trifluoromethyl)pyrimidin-2-yl]-methylamino]ethanol?
The IUPAC name of 2-[[4-ethyl-6-(trifluoromethyl)pyrimidin-2-yl]-methylamino]ethanol (CID 10467229) is 2-[[4-ethyl-6-(trifluoromethyl)pyrimidin-2-yl]-methylamino]ethanol.
What is the SMILES notation for 2-[[4-ethyl-6-(trifluoromethyl)pyrimidin-2-yl]-methylamino]ethanol?
The canonical SMILES for 2-[[4-ethyl-6-(trifluoromethyl)pyrimidin-2-yl]-methylamino]ethanol is CCc1cc(C(F)(F)F)nc(N(C)CCO)n1.
What is the InChIKey of 2-[[4-ethyl-6-(trifluoromethyl)pyrimidin-2-yl]-methylamino]ethanol?
The InChIKey is RSBSKCQCLXRCLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F3N3O/c1-3-7-6-8(10(11,12)13)15-9(14-7)16(2)4-5-17/h6,17H,3-5H2,1-2H3.
What are the key properties of 2-[[4-ethyl-6-(trifluoromethyl)pyrimidin-2-yl]-methylamino]ethanol?
2-[[4-ethyl-6-(trifluoromethyl)pyrimidin-2-yl]-methylamino]ethanol has a molecular weight of 249.24 g/mol, XLogP of 1.49, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-ethyl-6-(trifluoromethyl)pyrimidin-2-yl]-methylamino]ethanol is sourced from PubChem (CID 10467229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).