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

C10H18F3NO2 — CID 62390317

IUPAC[4-[[methyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol
SMILESCN(CC(F)(F)F)CC1(CO)CCOCC1
InChIInChI=1S/C10H18F3NO2/c1-14(7-10(11,12)13)6-9(8-15)2-4-16-5-3-9/h15H,2-8H2,1H3
InChIKeyYAZOVJWIFCHCMZ-UHFFFAOYSA-N
MW241.25 g/mol
LogP1.27
Rot. Bonds4

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

[4-[[methyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol (PubChem CID 62390317) has the molecular formula C10H18F3NO2 and a molecular weight of 241.25 g/mol. Its IUPAC name is [4-[[methyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol.

Molecular Properties

Compound Name[4-[[methyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol
PubChem CID62390317
Molecular FormulaC10H18F3NO2
Molecular Weight241.25 g/mol
Exact Mass241.13
IUPAC Name[4-[[methyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol
SMILESCN(CC(F)(F)F)CC1(CO)CCOCC1
InChIInChI=1S/C10H18F3NO2/c1-14(7-10(11,12)13)6-9(8-15)2-4-16-5-3-9/h15H,2-8H2,1H3
InChIKeyYAZOVJWIFCHCMZ-UHFFFAOYSA-N
XLogP1.27
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-[[methyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol?
The IUPAC name of [4-[[methyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol (CID 62390317) is [4-[[methyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol.
What is the SMILES notation for [4-[[methyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol?
The canonical SMILES for [4-[[methyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol is CN(CC(F)(F)F)CC1(CO)CCOCC1.
What is the InChIKey of [4-[[methyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol?
The InChIKey is YAZOVJWIFCHCMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3NO2/c1-14(7-10(11,12)13)6-9(8-15)2-4-16-5-3-9/h15H,2-8H2,1H3.
What are the key properties of [4-[[methyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol?
[4-[[methyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol has a molecular weight of 241.25 g/mol, XLogP of 1.27, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[methyl(2,2,2-trifluoroethyl)amino]methyl]oxan-4-yl]methanol is sourced from PubChem (CID 62390317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).