[4-[2-(trifluoromethoxy)ethyl]morpholin-2-yl]methanol

C8H14F3NO3 — CID 81219382

IUPAC[4-[2-(trifluoromethoxy)ethyl]morpholin-2-yl]methanol
SMILESOCC1CN(CCOC(F)(F)F)CCO1
InChIInChI=1S/C8H14F3NO3/c9-8(10,11)15-4-2-12-1-3-14-7(5-12)6-13/h7,13H,1-6H2
InChIKeyWVRPFGGRIYEAGF-UHFFFAOYSA-N
MW229.20 g/mol
LogP0.22
Rot. Bonds4

About [4-[2-(trifluoromethoxy)ethyl]morpholin-2-yl]methanol

[4-[2-(trifluoromethoxy)ethyl]morpholin-2-yl]methanol (PubChem CID 81219382) has the molecular formula C8H14F3NO3 and a molecular weight of 229.20 g/mol. Its IUPAC name is [4-[2-(trifluoromethoxy)ethyl]morpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[2-(trifluoromethoxy)ethyl]morpholin-2-yl]methanol
PubChem CID81219382
Molecular FormulaC8H14F3NO3
Molecular Weight229.20 g/mol
Exact Mass229.09
IUPAC Name[4-[2-(trifluoromethoxy)ethyl]morpholin-2-yl]methanol
SMILESOCC1CN(CCOC(F)(F)F)CCO1
InChIInChI=1S/C8H14F3NO3/c9-8(10,11)15-4-2-12-1-3-14-7(5-12)6-13/h7,13H,1-6H2
InChIKeyWVRPFGGRIYEAGF-UHFFFAOYSA-N
XLogP0.22
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.20
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

trifluoro-[[2-(hydroxymethyl)morpholin-4-yl]methyl]boranuide
CID 79016153
(4-pent-4-ynylmorpholin-2-yl)methanol
CID 115873222
[4-[2-[4-(aminomethyl)phenoxy]ethyl]morpholin-2-yl]methanol
CID 81202906
[4-[2-(4-fluorophenyl)sulfanylethyl]morpholin-2-yl]methanol
CID 79841047
2-(chloromethyl)-4-(2-methoxyethyl)morpholine
CID 71380067
3-[2-(hydroxymethyl)morpholin-4-yl]-1-(4-methylphenyl)propan-1-one
CID 81214433
(4-prop-2-ynylmorpholin-2-yl)methanol
CID 79833462
[4-(3-azidopropyl)morpholin-2-yl]methanol
CID 81219129
tert-butyl 2-[(2R)-2-(hydroxymethyl)morpholin-4-yl]acetate
CID 156853972
tert-butyl 2-[2-(hydroxymethyl)morpholin-4-yl]acetate
CID 79833522
3-[2-[2-(hydroxymethyl)morpholin-4-yl]ethoxy]benzohydrazide
CID 81214161
4-[[2-(hydroxymethyl)morpholin-4-yl]methyl]benzoic acid
CID 81205300

Frequently Asked Questions

What is the IUPAC name of [4-[2-(trifluoromethoxy)ethyl]morpholin-2-yl]methanol?
The IUPAC name of [4-[2-(trifluoromethoxy)ethyl]morpholin-2-yl]methanol (CID 81219382) is [4-[2-(trifluoromethoxy)ethyl]morpholin-2-yl]methanol.
What is the SMILES notation for [4-[2-(trifluoromethoxy)ethyl]morpholin-2-yl]methanol?
The canonical SMILES for [4-[2-(trifluoromethoxy)ethyl]morpholin-2-yl]methanol is OCC1CN(CCOC(F)(F)F)CCO1.
What is the InChIKey of [4-[2-(trifluoromethoxy)ethyl]morpholin-2-yl]methanol?
The InChIKey is WVRPFGGRIYEAGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F3NO3/c9-8(10,11)15-4-2-12-1-3-14-7(5-12)6-13/h7,13H,1-6H2.
What are the key properties of [4-[2-(trifluoromethoxy)ethyl]morpholin-2-yl]methanol?
[4-[2-(trifluoromethoxy)ethyl]morpholin-2-yl]methanol has a molecular weight of 229.20 g/mol, XLogP of 0.22, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-(trifluoromethoxy)ethyl]morpholin-2-yl]methanol is sourced from PubChem (CID 81219382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).