1-ethoxy-1-(trifluoromethyl)cyclopentane

C8H13F3O — CID 164600656

IUPAC1-ethoxy-1-(trifluoromethyl)cyclopentane
SMILESCCOC1(C(F)(F)F)CCCC1
InChIInChI=1S/C8H13F3O/c1-2-12-7(8(9,10)11)5-3-4-6-7/h2-6H2,1H3
InChIKeyKGMZUPUQYNQMLZ-UHFFFAOYSA-N
MW182.18 g/mol
LogP2.90
Rot. Bonds2

About 1-ethoxy-1-(trifluoromethyl)cyclopentane

1-ethoxy-1-(trifluoromethyl)cyclopentane (PubChem CID 164600656) has the molecular formula C8H13F3O and a molecular weight of 182.18 g/mol. Its IUPAC name is 1-ethoxy-1-(trifluoromethyl)cyclopentane.

Molecular Properties

Compound Name1-ethoxy-1-(trifluoromethyl)cyclopentane
PubChem CID164600656
Molecular FormulaC8H13F3O
Molecular Weight182.18 g/mol
Exact Mass182.09
IUPAC Name1-ethoxy-1-(trifluoromethyl)cyclopentane
SMILESCCOC1(C(F)(F)F)CCCC1
InChIInChI=1S/C8H13F3O/c1-2-12-7(8(9,10)11)5-3-4-6-7/h2-6H2,1H3
InChIKeyKGMZUPUQYNQMLZ-UHFFFAOYSA-N
XLogP2.90
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.18
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-ethoxy-1-(trifluoromethyl)cyclopentane 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-[1-(trifluoromethyl)cyclohexyl]oxyethanol
CID 166516995
2-[(3R)-3-ethoxy-3-(trifluoromethyl)pyrrolidin-1-yl]acetic acid
CID 129497203
2-[(3S)-3-ethoxy-3-(trifluoromethyl)pyrrolidin-1-yl]acetic acid
CID 129497204
[1-(trifluoromethyl)cyclohexyl] formate
CID 56976282
1-[2-methyl-1,1-bis[[1-(trifluoromethyl)cyclohexyl]oxy]decoxy]-1-(trifluoromethyl)cyclohexane
CID 152633194
1-ethoxy-1-(1-ethoxycyclohexyl)oxycyclohexane
CID 154120160
[1-(trifluoromethyl)cyclohexyl] 2,2-dimethylpropanoate
CID 130411165
1,1,3,3-tetraethoxycyclohexane
CID 151917056
2,2-diethoxycyclohexan-1-ol
CID 85385417
(1-ethoxycyclopentyl)-[2-(trifluoromethyl)phenyl]methanone
CID 116747862
ethyl 3-[2-[1-(trifluoromethyl)cyclobutyl]oxyethylamino]-1H-pyrrole-2-carboxylate
CID 166517032
1-ethoxy-1-propylcyclohexane
CID 154221474

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-1-(trifluoromethyl)cyclopentane?
The IUPAC name of 1-ethoxy-1-(trifluoromethyl)cyclopentane (CID 164600656) is 1-ethoxy-1-(trifluoromethyl)cyclopentane.
What is the SMILES notation for 1-ethoxy-1-(trifluoromethyl)cyclopentane?
The canonical SMILES for 1-ethoxy-1-(trifluoromethyl)cyclopentane is CCOC1(C(F)(F)F)CCCC1.
What is the InChIKey of 1-ethoxy-1-(trifluoromethyl)cyclopentane?
The InChIKey is KGMZUPUQYNQMLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13F3O/c1-2-12-7(8(9,10)11)5-3-4-6-7/h2-6H2,1H3.
What are the key properties of 1-ethoxy-1-(trifluoromethyl)cyclopentane?
1-ethoxy-1-(trifluoromethyl)cyclopentane has a molecular weight of 182.18 g/mol, XLogP of 2.90, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-1-(trifluoromethyl)cyclopentane is sourced from PubChem (CID 164600656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).