[1-(methylamino)-3-(2,2,2-trifluoroethoxy)cyclohexyl]methanol

C10H18F3NO2 — CID 79640576

IUPAC[1-(methylamino)-3-(2,2,2-trifluoroethoxy)cyclohexyl]methanol
SMILESCNC1(CO)CCCC(OCC(F)(F)F)C1
InChIInChI=1S/C10H18F3NO2/c1-14-9(6-15)4-2-3-8(5-9)16-7-10(11,12)13/h8,14-15H,2-7H2,1H3
InChIKeyOAFHWLFKWSNXJW-UHFFFAOYSA-N
MW241.25 g/mol
LogP1.46
Rot. Bonds4

About [1-(methylamino)-3-(2,2,2-trifluoroethoxy)cyclohexyl]methanol

[1-(methylamino)-3-(2,2,2-trifluoroethoxy)cyclohexyl]methanol (PubChem CID 79640576) has the molecular formula C10H18F3NO2 and a molecular weight of 241.25 g/mol. Its IUPAC name is [1-(methylamino)-3-(2,2,2-trifluoroethoxy)cyclohexyl]methanol.

Molecular Properties

Compound Name[1-(methylamino)-3-(2,2,2-trifluoroethoxy)cyclohexyl]methanol
PubChem CID79640576
Molecular FormulaC10H18F3NO2
Molecular Weight241.25 g/mol
Exact Mass241.13
IUPAC Name[1-(methylamino)-3-(2,2,2-trifluoroethoxy)cyclohexyl]methanol
SMILESCNC1(CO)CCCC(OCC(F)(F)F)C1
InChIInChI=1S/C10H18F3NO2/c1-14-9(6-15)4-2-3-8(5-9)16-7-10(11,12)13/h8,14-15H,2-7H2,1H3
InChIKeyOAFHWLFKWSNXJW-UHFFFAOYSA-N
XLogP1.46
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [1-(methylamino)-3-(2,2,2-trifluoroethoxy)cyclohexyl]methanol 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 [1-(methylamino)-3-(2,2,2-trifluoroethoxy)cyclohexyl]methanol?
The IUPAC name of [1-(methylamino)-3-(2,2,2-trifluoroethoxy)cyclohexyl]methanol (CID 79640576) is [1-(methylamino)-3-(2,2,2-trifluoroethoxy)cyclohexyl]methanol.
What is the SMILES notation for [1-(methylamino)-3-(2,2,2-trifluoroethoxy)cyclohexyl]methanol?
The canonical SMILES for [1-(methylamino)-3-(2,2,2-trifluoroethoxy)cyclohexyl]methanol is CNC1(CO)CCCC(OCC(F)(F)F)C1.
What is the InChIKey of [1-(methylamino)-3-(2,2,2-trifluoroethoxy)cyclohexyl]methanol?
The InChIKey is OAFHWLFKWSNXJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3NO2/c1-14-9(6-15)4-2-3-8(5-9)16-7-10(11,12)13/h8,14-15H,2-7H2,1H3.
What are the key properties of [1-(methylamino)-3-(2,2,2-trifluoroethoxy)cyclohexyl]methanol?
[1-(methylamino)-3-(2,2,2-trifluoroethoxy)cyclohexyl]methanol has a molecular weight of 241.25 g/mol, XLogP of 1.46, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(methylamino)-3-(2,2,2-trifluoroethoxy)cyclohexyl]methanol is sourced from PubChem (CID 79640576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).