2-[1-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-2-yl]cyclopentan-1-ol

C14H24F3NO2 — CID 114340242

IUPAC2-[1-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-2-yl]cyclopentan-1-ol
SMILESOC1CCCC1C1CCCCN1CCOCC(F)(F)F
InChIInChI=1S/C14H24F3NO2/c15-14(16,17)10-20-9-8-18-7-2-1-5-12(18)11-4-3-6-13(11)19/h11-13,19H,1-10H2
InChIKeyKVGLKJFBNZEHRD-UHFFFAOYSA-N
MW295.34 g/mol
LogP2.58
Rot. Bonds5

About 2-[1-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-2-yl]cyclopentan-1-ol

2-[1-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-2-yl]cyclopentan-1-ol (PubChem CID 114340242) has the molecular formula C14H24F3NO2 and a molecular weight of 295.34 g/mol. Its IUPAC name is 2-[1-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-2-yl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[1-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-2-yl]cyclopentan-1-ol
PubChem CID114340242
Molecular FormulaC14H24F3NO2
Molecular Weight295.34 g/mol
Exact Mass295.18
IUPAC Name2-[1-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-2-yl]cyclopentan-1-ol
SMILESOC1CCCC1C1CCCCN1CCOCC(F)(F)F
InChIInChI=1S/C14H24F3NO2/c15-14(16,17)10-20-9-8-18-7-2-1-5-12(18)11-4-3-6-13(11)19/h11-13,19H,1-10H2
InChIKeyKVGLKJFBNZEHRD-UHFFFAOYSA-N
XLogP2.58
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1,1,1-Trifluoro-3-(9-oxa-6-azaspiro[4.5]decan-6-yl)propan-2-ol
CID 86792788
(2S)-1-cyclopentyl-3-(4-ethoxypiperidin-1-yl)propan-2-ol
CID 99826157
4,4,6,6,7,7,8,9,9,9-Decafluoro-1-morpholin-4-yl-8-(trifluoromethyl)nonan-2-ol
CID 58855395
4,4,6,6,7,7,8,8,9,9,10,11,11,11-Tetradecafluoro-1-morpholin-4-yl-10-(trifluoromethyl)undecan-2-ol
CID 58855487
4,4,5,5,6,6,7,7,8,9,9,9-Dodecafluoro-1-morpholin-4-yl-8-(trifluoromethyl)nonan-2-ol
CID 89220132
4,4,7,7,9,9,10,11,11,11-Decafluoro-1-morpholin-4-yl-10-(trifluoromethyl)undecan-2-ol
CID 89623509
4,4,7,7,8,9,9,9-Octafluoro-1-morpholin-4-yl-8-(trifluoromethyl)nonan-2-ol
CID 89623964
1,2,2-Trifluoro-2-[5-(1,1,1,2,3-pentafluoro-3-morpholin-4-ylpropan-2-yl)oxolan-2-yl]ethanol
CID 130427330
4,4,4-Trifluoro-1-(1-morpholin-4-ylcyclopentyl)butan-1-ol
CID 79060223
(2S)-1,1,1-trifluoro-3-(9-oxa-6-azaspiro[4.5]decan-6-yl)propan-2-ol
CID 97881459
(2R)-1,1,1-trifluoro-3-(9-oxa-6-azaspiro[4.5]decan-6-yl)propan-2-ol
CID 97881460
2,2,2-Trifluoro-1-(2-morpholin-4-ylcyclohexyl)ethanol
CID 101501910

Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-2-yl]cyclopentan-1-ol?
The IUPAC name of 2-[1-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-2-yl]cyclopentan-1-ol (CID 114340242) is 2-[1-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-2-yl]cyclopentan-1-ol.
What is the SMILES notation for 2-[1-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-2-yl]cyclopentan-1-ol?
The canonical SMILES for 2-[1-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-2-yl]cyclopentan-1-ol is OC1CCCC1C1CCCCN1CCOCC(F)(F)F.
What is the InChIKey of 2-[1-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-2-yl]cyclopentan-1-ol?
The InChIKey is KVGLKJFBNZEHRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24F3NO2/c15-14(16,17)10-20-9-8-18-7-2-1-5-12(18)11-4-3-6-13(11)19/h11-13,19H,1-10H2.
What are the key properties of 2-[1-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-2-yl]cyclopentan-1-ol?
2-[1-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-2-yl]cyclopentan-1-ol has a molecular weight of 295.34 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-2-yl]cyclopentan-1-ol is sourced from PubChem (CID 114340242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).