(4-methylmorpholin-2-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol

C12H15F3N2O2 — CID 102707853

IUPAC(4-methylmorpholin-2-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
SMILESCN1CCOC(C(O)c2cnccc2C(F)(F)F)C1
InChIInChI=1S/C12H15F3N2O2/c1-17-4-5-19-10(7-17)11(18)8-6-16-3-2-9(8)12(13,14)15/h2-3,6,10-11,18H,4-5,7H2,1H3
InChIKeyZWFKYTHAAAPYKE-UHFFFAOYSA-N
MW276.26 g/mol
LogP1.46
Rot. Bonds2

About (4-methylmorpholin-2-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol

(4-methylmorpholin-2-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol (PubChem CID 102707853) has the molecular formula C12H15F3N2O2 and a molecular weight of 276.26 g/mol. Its IUPAC name is (4-methylmorpholin-2-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol.

Molecular Properties

Compound Name(4-methylmorpholin-2-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
PubChem CID102707853
Molecular FormulaC12H15F3N2O2
Molecular Weight276.26 g/mol
Exact Mass276.11
IUPAC Name(4-methylmorpholin-2-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
SMILESCN1CCOC(C(O)c2cnccc2C(F)(F)F)C1
InChIInChI=1S/C12H15F3N2O2/c1-17-4-5-19-10(7-17)11(18)8-6-16-3-2-9(8)12(13,14)15/h2-3,6,10-11,18H,4-5,7H2,1H3
InChIKeyZWFKYTHAAAPYKE-UHFFFAOYSA-N
XLogP1.46
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.26
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4-methylmorpholin-2-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanamine
CID 102708320
isoquinolin-8-yl-(4-methylmorpholin-2-yl)methanol
CID 103143463
(4-methylmorpholin-2-yl)-pyridin-3-ylmethanol
CID 79087770
(2-fluorophenyl)-(4-methylmorpholin-2-yl)methanol
CID 79087093
1-(1,4-dimethylpiperazin-2-yl)-N-methyl-1-[4-(trifluoromethyl)-3-pyridinyl]methanamine
CID 102708352
3-[methylamino-(4-methylmorpholin-2-yl)methyl]pyridin-4-amine
CID 79092957
(4-methylmorpholin-2-yl)-(2-methylthiophen-3-yl)methanol
CID 102831436
(2-methoxyphenyl)-(4-methylmorpholin-2-yl)methanol
CID 79086803
[4-(trifluoromethyl)-3-pyridinyl]methanediol
CID 162592484
(2-fluoro-4-methoxyphenyl)-(4-methylmorpholin-2-yl)methanol
CID 103395437
[4-(trifluoromethyl)-3-pyridinyl]-(2,4,5-trimethyloxolan-3-yl)methanol
CID 102710226
piperidin-4-yl-[4-(trifluoromethyl)-3-pyridinyl]methanol
CID 102707413

Frequently Asked Questions

What is the IUPAC name of (4-methylmorpholin-2-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol?
The IUPAC name of (4-methylmorpholin-2-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol (CID 102707853) is (4-methylmorpholin-2-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol.
What is the SMILES notation for (4-methylmorpholin-2-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol?
The canonical SMILES for (4-methylmorpholin-2-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol is CN1CCOC(C(O)c2cnccc2C(F)(F)F)C1.
What is the InChIKey of (4-methylmorpholin-2-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol?
The InChIKey is ZWFKYTHAAAPYKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F3N2O2/c1-17-4-5-19-10(7-17)11(18)8-6-16-3-2-9(8)12(13,14)15/h2-3,6,10-11,18H,4-5,7H2,1H3.
What are the key properties of (4-methylmorpholin-2-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol?
(4-methylmorpholin-2-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol has a molecular weight of 276.26 g/mol, XLogP of 1.46, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylmorpholin-2-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol is sourced from PubChem (CID 102707853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).