2-(2,4-dichlorophenyl)-1-(2-methylcyclopentyl)ethanol

C14H18Cl2O — CID 107192122

IUPAC2-(2,4-dichlorophenyl)-1-(2-methylcyclopentyl)ethanol
SMILESCC1CCCC1C(O)Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C14H18Cl2O/c1-9-3-2-4-12(9)14(17)7-10-5-6-11(15)8-13(10)16/h5-6,8-9,12,14,17H,2-4,7H2,1H3
InChIKeyFVIHQJXTMATACZ-UHFFFAOYSA-N
MW273.20 g/mol
LogP4.33
Rot. Bonds3

About 2-(2,4-dichlorophenyl)-1-(2-methylcyclopentyl)ethanol

2-(2,4-dichlorophenyl)-1-(2-methylcyclopentyl)ethanol (PubChem CID 107192122) has the molecular formula C14H18Cl2O and a molecular weight of 273.20 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-1-(2-methylcyclopentyl)ethanol.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-1-(2-methylcyclopentyl)ethanol
PubChem CID107192122
Molecular FormulaC14H18Cl2O
Molecular Weight273.20 g/mol
Exact Mass272.07
IUPAC Name2-(2,4-dichlorophenyl)-1-(2-methylcyclopentyl)ethanol
SMILESCC1CCCC1C(O)Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C14H18Cl2O/c1-9-3-2-4-12(9)14(17)7-10-5-6-11(15)8-13(10)16/h5-6,8-9,12,14,17H,2-4,7H2,1H3
InChIKeyFVIHQJXTMATACZ-UHFFFAOYSA-N
XLogP4.33
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.20
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,3-bis(2,4-dichlorophenyl)propan-2-ol
CID 63410533
2-(2-bromo-3-fluorophenyl)-1-(2-methylcyclopentyl)ethanol
CID 107192743
2-(2,4-dichlorophenyl)-1-(3-ethyl-1,4-dithian-2-yl)ethanol
CID 115386317
1-cyclobutyl-2-(2,5-dichlorophenyl)ethanol
CID 65321223
2-(2-chloro-4-fluorophenyl)-1-(2-methylcyclopentyl)ethanamine
CID 107188247
methyl (2R)-3-(2,4-dichlorophenyl)-2-[(5R)-5-methylcyclodecyl]propanoate
CID 134591238
[1-(6-bicyclo[3.1.0]hexanyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine
CID 105295110
1-(2,4-dichlorophenyl)butan-2-ol;methanol
CID 144705825
2-(2,4-dichlorophenyl)-1-(2,3-dihydro-1-benzothiophen-3-yl)ethanol
CID 105086826
1-cycloheptyl-3-(2,4-dichlorophenyl)-N-methylpropan-2-amine
CID 115839945
1-(1,4-diazabicyclo[2.2.2]octan-2-yl)-2-(2,4-dichlorophenyl)ethanol
CID 79968525
N-(2-cyclopentyl-2-hydroxyethyl)-3-(2,4-dichlorophenyl)-2-methylpropanamide
CID 86970189

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-1-(2-methylcyclopentyl)ethanol?
The IUPAC name of 2-(2,4-dichlorophenyl)-1-(2-methylcyclopentyl)ethanol (CID 107192122) is 2-(2,4-dichlorophenyl)-1-(2-methylcyclopentyl)ethanol.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-1-(2-methylcyclopentyl)ethanol?
The canonical SMILES for 2-(2,4-dichlorophenyl)-1-(2-methylcyclopentyl)ethanol is CC1CCCC1C(O)Cc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2,4-dichlorophenyl)-1-(2-methylcyclopentyl)ethanol?
The InChIKey is FVIHQJXTMATACZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18Cl2O/c1-9-3-2-4-12(9)14(17)7-10-5-6-11(15)8-13(10)16/h5-6,8-9,12,14,17H,2-4,7H2,1H3.
What are the key properties of 2-(2,4-dichlorophenyl)-1-(2-methylcyclopentyl)ethanol?
2-(2,4-dichlorophenyl)-1-(2-methylcyclopentyl)ethanol has a molecular weight of 273.20 g/mol, XLogP of 4.33, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-1-(2-methylcyclopentyl)ethanol is sourced from PubChem (CID 107192122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).