1-(2-methylcyclopentyl)-2-[4-(trifluoromethyl)phenyl]ethanol

C15H19F3O — CID 107183450

IUPAC1-(2-methylcyclopentyl)-2-[4-(trifluoromethyl)phenyl]ethanol
SMILESCC1CCCC1C(O)Cc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H19F3O/c1-10-3-2-4-13(10)14(19)9-11-5-7-12(8-6-11)15(16,17)18/h5-8,10,13-14,19H,2-4,9H2,1H3
InChIKeyURFFBVKTLJPRKV-UHFFFAOYSA-N
MW272.31 g/mol
LogP4.05
Rot. Bonds3

About 1-(2-methylcyclopentyl)-2-[4-(trifluoromethyl)phenyl]ethanol

1-(2-methylcyclopentyl)-2-[4-(trifluoromethyl)phenyl]ethanol (PubChem CID 107183450) has the molecular formula C15H19F3O and a molecular weight of 272.31 g/mol. Its IUPAC name is 1-(2-methylcyclopentyl)-2-[4-(trifluoromethyl)phenyl]ethanol.

Molecular Properties

Compound Name1-(2-methylcyclopentyl)-2-[4-(trifluoromethyl)phenyl]ethanol
PubChem CID107183450
Molecular FormulaC15H19F3O
Molecular Weight272.31 g/mol
Exact Mass272.14
IUPAC Name1-(2-methylcyclopentyl)-2-[4-(trifluoromethyl)phenyl]ethanol
SMILESCC1CCCC1C(O)Cc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H19F3O/c1-10-3-2-4-13(10)14(19)9-11-5-7-12(8-6-11)15(16,17)18/h5-8,10,13-14,19H,2-4,9H2,1H3
InChIKeyURFFBVKTLJPRKV-UHFFFAOYSA-N
XLogP4.05
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 ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclopentyl-2-[4-(trifluoromethyl)phenyl]ethanol
CID 62607269
2-(4-methoxyphenyl)-1-(2-methylcyclopentyl)ethanol
CID 107183403
1-(3-ethylcyclopentyl)-2-[4-(trifluoromethyl)phenyl]ethanol
CID 65410943
1-cyclohexyl-3-[4-(trifluoromethyl)phenyl]propan-2-ol
CID 63520008
2-(4-tert-butylphenyl)-N-methyl-1-(2-methylcyclopentyl)ethanamine
CID 107188307
1-(1,4-dimethylpiperazin-2-yl)-2-[4-(trifluoromethyl)phenyl]ethanol
CID 79663724
2,3-dimethyl-1-[[4-(trifluoromethyl)phenyl]methyl]cyclohexan-1-ol
CID 65153585
1-cyclobutyl-N-methyl-3-[4-(trifluoromethyl)phenyl]propan-2-amine
CID 115863531
1-cyclobutyl-N-ethyl-2-[4-(trifluoromethyl)phenyl]ethanamine
CID 55040821
2-(4-tert-butylphenyl)-1-cyclopropylethanol
CID 62608769
1-(4-methylthiomorpholin-3-yl)-2-[4-(trifluoromethyl)phenyl]ethanol
CID 103595739
2-(1-ethylpyrazol-4-yl)-1-(2-methylcyclopentyl)ethanol
CID 107192051

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylcyclopentyl)-2-[4-(trifluoromethyl)phenyl]ethanol?
The IUPAC name of 1-(2-methylcyclopentyl)-2-[4-(trifluoromethyl)phenyl]ethanol (CID 107183450) is 1-(2-methylcyclopentyl)-2-[4-(trifluoromethyl)phenyl]ethanol.
What is the SMILES notation for 1-(2-methylcyclopentyl)-2-[4-(trifluoromethyl)phenyl]ethanol?
The canonical SMILES for 1-(2-methylcyclopentyl)-2-[4-(trifluoromethyl)phenyl]ethanol is CC1CCCC1C(O)Cc1ccc(C(F)(F)F)cc1.
What is the InChIKey of 1-(2-methylcyclopentyl)-2-[4-(trifluoromethyl)phenyl]ethanol?
The InChIKey is URFFBVKTLJPRKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F3O/c1-10-3-2-4-13(10)14(19)9-11-5-7-12(8-6-11)15(16,17)18/h5-8,10,13-14,19H,2-4,9H2,1H3.
What are the key properties of 1-(2-methylcyclopentyl)-2-[4-(trifluoromethyl)phenyl]ethanol?
1-(2-methylcyclopentyl)-2-[4-(trifluoromethyl)phenyl]ethanol has a molecular weight of 272.31 g/mol, XLogP of 4.05, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylcyclopentyl)-2-[4-(trifluoromethyl)phenyl]ethanol is sourced from PubChem (CID 107183450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).