3-ethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclopentan-1-ol

C15H19F3O — CID 65154101

IUPAC3-ethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclopentan-1-ol
SMILESCCC1CCC(O)(Cc2cccc(C(F)(F)F)c2)C1
InChIInChI=1S/C15H19F3O/c1-2-11-6-7-14(19,9-11)10-12-4-3-5-13(8-12)15(16,17)18/h3-5,8,11,19H,2,6-7,9-10H2,1H3
InChIKeyDKIDRSAKEXZCDN-UHFFFAOYSA-N
MW272.31 g/mol
LogP4.19
Rot. Bonds3

About 3-ethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclopentan-1-ol

3-ethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclopentan-1-ol (PubChem CID 65154101) has the molecular formula C15H19F3O and a molecular weight of 272.31 g/mol. Its IUPAC name is 3-ethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name3-ethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclopentan-1-ol
PubChem CID65154101
Molecular FormulaC15H19F3O
Molecular Weight272.31 g/mol
Exact Mass272.14
IUPAC Name3-ethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclopentan-1-ol
SMILESCCC1CCC(O)(Cc2cccc(C(F)(F)F)c2)C1
InChIInChI=1S/C15H19F3O/c1-2-11-6-7-14(19,9-11)10-12-4-3-5-13(8-12)15(16,17)18/h3-5,8,11,19H,2,6-7,9-10H2,1H3
InChIKeyDKIDRSAKEXZCDN-UHFFFAOYSA-N
XLogP4.19
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-ethyl-1-[[4-(trifluoromethyl)phenyl]methyl]cyclopentan-1-ol
CID 65154318
[3-ethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclopentyl]methanamine
CID 65407301
3-methoxy-1-[[3-(trifluoromethyl)phenyl]methyl]cyclohexan-1-ol
CID 106874015
2-ethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclohexan-1-ol
CID 65149544
1-[(3-chloro-4-fluorophenyl)methyl]-3-ethylcyclopentan-1-ol
CID 103039036
1-[[3-(2-fluoropropan-2-yl)phenyl]methyl]cyclopropan-1-ol
CID 117297832
3-fluoro-3-[[3-(trifluoromethyl)phenyl]methyl]cyclohexan-1-amine
CID 112567629
tert-butyl 3-hydroxy-3-[[3-(trifluoromethyl)phenyl]methyl]-8-azabicyclo[3.2.1]octane-8-carboxylate
CID 171963980
N-ethyl-3-methyl-3-[[3-(trifluoromethyl)phenyl]methyl]cyclopentan-1-amine
CID 116539278
1-[(3-bromo-4-methoxyphenyl)methyl]-3-ethylcyclopentan-1-ol
CID 64514304
1-(4-ethylcyclohexyl)-2-[3-(trifluoromethyl)phenyl]ethanone
CID 65393505
1-[(3,4-dimethylphenyl)methyl]-4-ethylcyclohexan-1-ol
CID 63406863

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclopentan-1-ol?
The IUPAC name of 3-ethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclopentan-1-ol (CID 65154101) is 3-ethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclopentan-1-ol.
What is the SMILES notation for 3-ethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclopentan-1-ol?
The canonical SMILES for 3-ethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclopentan-1-ol is CCC1CCC(O)(Cc2cccc(C(F)(F)F)c2)C1.
What is the InChIKey of 3-ethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclopentan-1-ol?
The InChIKey is DKIDRSAKEXZCDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F3O/c1-2-11-6-7-14(19,9-11)10-12-4-3-5-13(8-12)15(16,17)18/h3-5,8,11,19H,2,6-7,9-10H2,1H3.
What are the key properties of 3-ethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclopentan-1-ol?
3-ethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclopentan-1-ol has a molecular weight of 272.31 g/mol, XLogP of 4.19, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-[[3-(trifluoromethyl)phenyl]methyl]cyclopentan-1-ol is sourced from PubChem (CID 65154101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).