[4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol

C11H20F3NO2 — CID 55067392

IUPAC[4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol
SMILESCCN(CC(F)(F)F)CC1(CO)CCOCC1
InChIInChI=1S/C11H20F3NO2/c1-2-15(8-11(12,13)14)7-10(9-16)3-5-17-6-4-10/h16H,2-9H2,1H3
InChIKeyKFAJABMRKNAQIH-UHFFFAOYSA-N
MW255.28 g/mol
LogP1.66
Rot. Bonds5

About [4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol

[4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol (PubChem CID 55067392) has the molecular formula C11H20F3NO2 and a molecular weight of 255.28 g/mol. Its IUPAC name is [4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol.

Molecular Properties

Compound Name[4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol
PubChem CID55067392
Molecular FormulaC11H20F3NO2
Molecular Weight255.28 g/mol
Exact Mass255.14
IUPAC Name[4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol
SMILESCCN(CC(F)(F)F)CC1(CO)CCOCC1
InChIInChI=1S/C11H20F3NO2/c1-2-15(8-11(12,13)14)7-10(9-16)3-5-17-6-4-10/h16H,2-9H2,1H3
InChIKeyKFAJABMRKNAQIH-UHFFFAOYSA-N
XLogP1.66
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol?
The IUPAC name of [4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol (CID 55067392) is [4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol.
What is the SMILES notation for [4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol?
The canonical SMILES for [4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol is CCN(CC(F)(F)F)CC1(CO)CCOCC1.
What is the InChIKey of [4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol?
The InChIKey is KFAJABMRKNAQIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F3NO2/c1-2-15(8-11(12,13)14)7-10(9-16)3-5-17-6-4-10/h16H,2-9H2,1H3.
What are the key properties of [4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol?
[4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol has a molecular weight of 255.28 g/mol, XLogP of 1.66, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol is sourced from PubChem (CID 55067392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).