2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol

C9H16F3NO2 — CID 103857817

IUPAC2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol
SMILESOCCN(CC(F)(F)F)C1CCCC1O
InChIInChI=1S/C9H16F3NO2/c10-9(11,12)6-13(4-5-14)7-2-1-3-8(7)15/h7-8,14-15H,1-6H2
InChIKeyKJHLGLMFANUFFM-UHFFFAOYSA-N
MW227.23 g/mol
LogP0.76
Rot. Bonds4

About 2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol

2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol (PubChem CID 103857817) has the molecular formula C9H16F3NO2 and a molecular weight of 227.23 g/mol. Its IUPAC name is 2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol
PubChem CID103857817
Molecular FormulaC9H16F3NO2
Molecular Weight227.23 g/mol
Exact Mass227.11
IUPAC Name2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol
SMILESOCCN(CC(F)(F)F)C1CCCC1O
InChIInChI=1S/C9H16F3NO2/c10-9(11,12)6-13(4-5-14)7-2-1-3-8(7)15/h7-8,14-15H,1-6H2
InChIKeyKJHLGLMFANUFFM-UHFFFAOYSA-N
XLogP0.76
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.23
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(Hydroxymethyl)-1-(4,4,4-trifluorobutyl)pyrrolidin-3-ol
CID 123908393
(2S,3R)-2-(hydroxymethyl)-1-(4,4,4-trifluorobutyl)pyrrolidin-3-ol
CID 129189864
1-[(2R)-4,4-difluoro-1-heptan-4-ylpyrrolidin-2-yl]ethanol
CID 129190742
(1S)-2,2,2-trifluoro-1-[(2S)-1-propan-2-ylpyrrolidin-2-yl]ethanol
CID 162751576
(1S)-1-[(2R)-3,3-difluoro-1-methylpyrrolidin-2-yl]ethanol;ethane
CID 168995788
(1R)-2,2,2-trifluoro-1-[(2R)-1-propan-2-ylpyrrolidin-2-yl]ethanol
CID 169177670
(1S)-1-[(2S)-1-ethylpyrrolidin-2-yl]-2,2,2-trifluoroethanol
CID 174164356
(1R)-1-[(2R)-1-ethylpyrrolidin-2-yl]-2,2,2-trifluoroethanol
CID 174164357
trans-(1R,2R)-2-(diethylamino)cyclopentan-1-ol
CID 12648824
2-[3-(Trifluoromethyl)piperidin-1-yl]cyclopentan-1-ol
CID 60712078
2-[Methyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol
CID 60886977
2-[Cyclopropyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol
CID 61607983

Frequently Asked Questions

What is the IUPAC name of 2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol?
The IUPAC name of 2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol (CID 103857817) is 2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol.
What is the SMILES notation for 2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol?
The canonical SMILES for 2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol is OCCN(CC(F)(F)F)C1CCCC1O.
What is the InChIKey of 2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol?
The InChIKey is KJHLGLMFANUFFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16F3NO2/c10-9(11,12)6-13(4-5-14)7-2-1-3-8(7)15/h7-8,14-15H,1-6H2.
What are the key properties of 2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol?
2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol has a molecular weight of 227.23 g/mol, XLogP of 0.76, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol is sourced from PubChem (CID 103857817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).