2-cyclohexyl-1-(3,3-difluorocyclohexyl)ethanol

C14H24F2O — CID 114215735

IUPAC2-cyclohexyl-1-(3,3-difluorocyclohexyl)ethanol
SMILESOC(CC1CCCCC1)C1CCCC(F)(F)C1
InChIInChI=1S/C14H24F2O/c15-14(16)8-4-7-12(10-14)13(17)9-11-5-2-1-3-6-11/h11-13,17H,1-10H2
InChIKeyCBJMJFAJZYENDT-UHFFFAOYSA-N
MW246.34 g/mol
LogP4.14
Rot. Bonds3

About 2-cyclohexyl-1-(3,3-difluorocyclohexyl)ethanol

2-cyclohexyl-1-(3,3-difluorocyclohexyl)ethanol (PubChem CID 114215735) has the molecular formula C14H24F2O and a molecular weight of 246.34 g/mol. Its IUPAC name is 2-cyclohexyl-1-(3,3-difluorocyclohexyl)ethanol.

Molecular Properties

Compound Name2-cyclohexyl-1-(3,3-difluorocyclohexyl)ethanol
PubChem CID114215735
Molecular FormulaC14H24F2O
Molecular Weight246.34 g/mol
Exact Mass246.18
IUPAC Name2-cyclohexyl-1-(3,3-difluorocyclohexyl)ethanol
SMILESOC(CC1CCCCC1)C1CCCC(F)(F)C1
InChIInChI=1S/C14H24F2O/c15-14(16)8-4-7-12(10-14)13(17)9-11-5-2-1-3-6-11/h11-13,17H,1-10H2
InChIKeyCBJMJFAJZYENDT-UHFFFAOYSA-N
XLogP4.14
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.34
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3,3-difluorocyclohexyl)-2-(oxan-4-yl)ethanol
CID 114215722
2-(3,3-difluorocyclohexyl)-1-(3-ethylcyclopentyl)ethanol
CID 114224702
1-cyclohexyl-3-(3,3-difluorocyclopentyl)propan-2-ol
CID 114224509
1-(3,3-difluorocyclohexyl)-3,5-dimethylhexan-1-ol
CID 114215688
1-cyclohexyl-3-(3,3-difluorocyclohexyl)-1-hydroxypropan-2-one
CID 114224662
(3R)-1,1-difluoro-3-(2-methylpropyl)cyclohexane
CID 121406277
(2S)-2-amino-2-(3,3-difluorocyclohexyl)ethanol
CID 160689350
(1R)-1-(3,3-difluorocyclohexyl)prop-2-yn-1-ol
CID 130563414
[cyclopropyl-(3,3-difluorocyclohexyl)methyl]hydrazine
CID 130485115
2-cyclohexyl-1-(2,2-dimethylcyclopentyl)ethanol
CID 107192138
1-cyclobutyl-2-cyclopropylethanol
CID 64986544
2-(aminomethyl)-1-(3,3-difluorocyclohexyl)-4-methylpentan-1-ol
CID 114226754

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1-(3,3-difluorocyclohexyl)ethanol?
The IUPAC name of 2-cyclohexyl-1-(3,3-difluorocyclohexyl)ethanol (CID 114215735) is 2-cyclohexyl-1-(3,3-difluorocyclohexyl)ethanol.
What is the SMILES notation for 2-cyclohexyl-1-(3,3-difluorocyclohexyl)ethanol?
The canonical SMILES for 2-cyclohexyl-1-(3,3-difluorocyclohexyl)ethanol is OC(CC1CCCCC1)C1CCCC(F)(F)C1.
What is the InChIKey of 2-cyclohexyl-1-(3,3-difluorocyclohexyl)ethanol?
The InChIKey is CBJMJFAJZYENDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24F2O/c15-14(16)8-4-7-12(10-14)13(17)9-11-5-2-1-3-6-11/h11-13,17H,1-10H2.
What are the key properties of 2-cyclohexyl-1-(3,3-difluorocyclohexyl)ethanol?
2-cyclohexyl-1-(3,3-difluorocyclohexyl)ethanol has a molecular weight of 246.34 g/mol, XLogP of 4.14, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1-(3,3-difluorocyclohexyl)ethanol is sourced from PubChem (CID 114215735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).