3-[[2-(2,2,2-trifluoroethoxy)ethylamino]methyl]cyclopentan-1-ol

C10H18F3NO2 — CID 106128936

IUPAC3-[[2-(2,2,2-trifluoroethoxy)ethylamino]methyl]cyclopentan-1-ol
SMILESOC1CCC(CNCCOCC(F)(F)F)C1
InChIInChI=1S/C10H18F3NO2/c11-10(12,13)7-16-4-3-14-6-8-1-2-9(15)5-8/h8-9,14-15H,1-7H2
InChIKeyNFERKCLBECNHHE-UHFFFAOYSA-N
MW241.25 g/mol
LogP1.32
Rot. Bonds6

About 3-[[2-(2,2,2-trifluoroethoxy)ethylamino]methyl]cyclopentan-1-ol

3-[[2-(2,2,2-trifluoroethoxy)ethylamino]methyl]cyclopentan-1-ol (PubChem CID 106128936) has the molecular formula C10H18F3NO2 and a molecular weight of 241.25 g/mol. Its IUPAC name is 3-[[2-(2,2,2-trifluoroethoxy)ethylamino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name3-[[2-(2,2,2-trifluoroethoxy)ethylamino]methyl]cyclopentan-1-ol
PubChem CID106128936
Molecular FormulaC10H18F3NO2
Molecular Weight241.25 g/mol
Exact Mass241.13
IUPAC Name3-[[2-(2,2,2-trifluoroethoxy)ethylamino]methyl]cyclopentan-1-ol
SMILESOC1CCC(CNCCOCC(F)(F)F)C1
InChIInChI=1S/C10H18F3NO2/c11-10(12,13)7-16-4-3-14-6-8-1-2-9(15)5-8/h8-9,14-15H,1-7H2
InChIKeyNFERKCLBECNHHE-UHFFFAOYSA-N
XLogP1.32
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-[[2-(2,2,2-Trifluoroethoxy)ethylamino]methyl]cyclopentan-1-ol
CID 65109102
1-[[(3,3,3-Trifluoro-2-hydroxypropyl)amino]methyl]cyclopentan-1-ol
CID 65111126
1-[[2-(Trifluoromethoxy)ethylamino]methyl]cyclopentan-1-ol
CID 65805407
2-[[2-(Trifluoromethoxy)ethylamino]methyl]cyclopentan-1-ol
CID 65838227
2-[[2-(2,2,2-Trifluoroethoxy)ethylamino]methyl]cyclopentan-1-ol
CID 65838852
[2-[[2-(2,2,2-Trifluoroethoxy)ethylamino]methyl]cyclopentyl]methanol
CID 65926094
1,1,1-Trifluoro-3-[2-(oxolan-3-yl)ethylamino]propan-2-ol
CID 102671693
1-Cyclopentyl-3-[2-(2,2,2-trifluoroethoxy)ethylamino]propan-2-ol
CID 103157807
3-[(6,6,6-Trifluorohexan-2-ylamino)methyl]cyclopentan-1-ol
CID 103271422
3-[(5,5-Dimethyloxolan-2-yl)methylamino]-1,1,1-trifluoropropan-2-ol
CID 105644895
3-[(5,5-Dimethyloxolan-2-yl)methylamino]-1,1-difluoropropan-2-ol
CID 105645401
1-[[(3,3-Difluoro-2-hydroxypropyl)amino]methyl]cyclopentan-1-ol
CID 105645734

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(2,2,2-trifluoroethoxy)ethylamino]methyl]cyclopentan-1-ol?
The IUPAC name of 3-[[2-(2,2,2-trifluoroethoxy)ethylamino]methyl]cyclopentan-1-ol (CID 106128936) is 3-[[2-(2,2,2-trifluoroethoxy)ethylamino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 3-[[2-(2,2,2-trifluoroethoxy)ethylamino]methyl]cyclopentan-1-ol?
The canonical SMILES for 3-[[2-(2,2,2-trifluoroethoxy)ethylamino]methyl]cyclopentan-1-ol is OC1CCC(CNCCOCC(F)(F)F)C1.
What is the InChIKey of 3-[[2-(2,2,2-trifluoroethoxy)ethylamino]methyl]cyclopentan-1-ol?
The InChIKey is NFERKCLBECNHHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3NO2/c11-10(12,13)7-16-4-3-14-6-8-1-2-9(15)5-8/h8-9,14-15H,1-7H2.
What are the key properties of 3-[[2-(2,2,2-trifluoroethoxy)ethylamino]methyl]cyclopentan-1-ol?
3-[[2-(2,2,2-trifluoroethoxy)ethylamino]methyl]cyclopentan-1-ol has a molecular weight of 241.25 g/mol, XLogP of 1.32, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(2,2,2-trifluoroethoxy)ethylamino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 106128936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).