4-ethyl-3-[2-fluoroethyl(2-methoxyethyl)amino]cyclohexan-1-ol

C13H26FNO2 — CID 165498064

IUPAC4-ethyl-3-[2-fluoroethyl(2-methoxyethyl)amino]cyclohexan-1-ol
SMILESCCC1CCC(O)CC1N(CCF)CCOC
InChIInChI=1S/C13H26FNO2/c1-3-11-4-5-12(16)10-13(11)15(7-6-14)8-9-17-2/h11-13,16H,3-10H2,1-2H3
InChIKeyUUJYFFZDJRDKNK-UHFFFAOYSA-N
MW247.35 g/mol
LogP1.84
Rot. Bonds7

About 4-ethyl-3-[2-fluoroethyl(2-methoxyethyl)amino]cyclohexan-1-ol

4-ethyl-3-[2-fluoroethyl(2-methoxyethyl)amino]cyclohexan-1-ol (PubChem CID 165498064) has the molecular formula C13H26FNO2 and a molecular weight of 247.35 g/mol. Its IUPAC name is 4-ethyl-3-[2-fluoroethyl(2-methoxyethyl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name4-ethyl-3-[2-fluoroethyl(2-methoxyethyl)amino]cyclohexan-1-ol
PubChem CID165498064
Molecular FormulaC13H26FNO2
Molecular Weight247.35 g/mol
Exact Mass247.19
IUPAC Name4-ethyl-3-[2-fluoroethyl(2-methoxyethyl)amino]cyclohexan-1-ol
SMILESCCC1CCC(O)CC1N(CCF)CCOC
InChIInChI=1S/C13H26FNO2/c1-3-11-4-5-12(16)10-13(11)15(7-6-14)8-9-17-2/h11-13,16H,3-10H2,1-2H3
InChIKeyUUJYFFZDJRDKNK-UHFFFAOYSA-N
XLogP1.84
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.35
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[Tert-butyl(ethyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490683
3-[(2-Methoxyethyl)(propan-2-yl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490684
3-[(2-Ethoxyethyl)(ethyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490685
3-[Cyclopropyl(methyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490687
3-[Cyclopropyl(ethyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490688
3-[Methyl(2-methylpropyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490689
3-[Cyclopentyl(methyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490691
3-[Methyl(2-methylbutan-2-yl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490692
3-[(Propan-2-yl)(propyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490693
3-[(3-Methoxypropyl)(methyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490694
3-[Cyclopropyl(2-methylpropyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490697
3-(2,2-Dimethylmorpholin-4-yl)-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490699

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3-[2-fluoroethyl(2-methoxyethyl)amino]cyclohexan-1-ol?
The IUPAC name of 4-ethyl-3-[2-fluoroethyl(2-methoxyethyl)amino]cyclohexan-1-ol (CID 165498064) is 4-ethyl-3-[2-fluoroethyl(2-methoxyethyl)amino]cyclohexan-1-ol.
What is the SMILES notation for 4-ethyl-3-[2-fluoroethyl(2-methoxyethyl)amino]cyclohexan-1-ol?
The canonical SMILES for 4-ethyl-3-[2-fluoroethyl(2-methoxyethyl)amino]cyclohexan-1-ol is CCC1CCC(O)CC1N(CCF)CCOC.
What is the InChIKey of 4-ethyl-3-[2-fluoroethyl(2-methoxyethyl)amino]cyclohexan-1-ol?
The InChIKey is UUJYFFZDJRDKNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26FNO2/c1-3-11-4-5-12(16)10-13(11)15(7-6-14)8-9-17-2/h11-13,16H,3-10H2,1-2H3.
What are the key properties of 4-ethyl-3-[2-fluoroethyl(2-methoxyethyl)amino]cyclohexan-1-ol?
4-ethyl-3-[2-fluoroethyl(2-methoxyethyl)amino]cyclohexan-1-ol has a molecular weight of 247.35 g/mol, XLogP of 1.84, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3-[2-fluoroethyl(2-methoxyethyl)amino]cyclohexan-1-ol is sourced from PubChem (CID 165498064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).