(1R)-1-(2-fluorophenyl)-3,3-dimethylcyclopentan-1-ol

C13H17FO — CID 124512737

IUPAC(1R)-1-(2-fluorophenyl)-3,3-dimethylcyclopentan-1-ol
SMILESCC1(C)CC[C@](O)(c2ccccc2F)C1
InChIInChI=1S/C13H17FO/c1-12(2)7-8-13(15,9-12)10-5-3-4-6-11(10)14/h3-6,15H,7-9H2,1-2H3/t13-/m1/s1
InChIKeyUVGKIMPMEGYJHS-CYBMUJFWSA-N
MW208.28 g/mol
LogP3.22
Rot. Bonds1

About (1R)-1-(2-fluorophenyl)-3,3-dimethylcyclopentan-1-ol

(1R)-1-(2-fluorophenyl)-3,3-dimethylcyclopentan-1-ol (PubChem CID 124512737) has the molecular formula C13H17FO and a molecular weight of 208.28 g/mol. Its IUPAC name is (1R)-1-(2-fluorophenyl)-3,3-dimethylcyclopentan-1-ol.

Molecular Properties

Compound Name(1R)-1-(2-fluorophenyl)-3,3-dimethylcyclopentan-1-ol
PubChem CID124512737
Molecular FormulaC13H17FO
Molecular Weight208.28 g/mol
Exact Mass208.13
IUPAC Name(1R)-1-(2-fluorophenyl)-3,3-dimethylcyclopentan-1-ol
SMILESCC1(C)CC[C@](O)(c2ccccc2F)C1
InChIInChI=1S/C13H17FO/c1-12(2)7-8-13(15,9-12)10-5-3-4-6-11(10)14/h3-6,15H,7-9H2,1-2H3/t13-/m1/s1
InChIKeyUVGKIMPMEGYJHS-CYBMUJFWSA-N
XLogP3.22
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.28
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-fluoro-3-methoxyphenyl)-3,3-dimethylcyclopentan-1-ol
CID 82805652
3,3-dimethyl-1-[2-(trifluoromethoxy)phenyl]cyclopentan-1-ol
CID 80699709
4-(2-fluorophenyl)oxan-4-ol
CID 63220717
1-(3-fluoro-2-methylphenyl)cyclopropan-1-ol
CID 117276386
3,3-dimethyl-1-(2,4,5-trimethylphenyl)cyclopentan-1-ol
CID 80699117
1-[4-(2-fluorophenyl)-4-hydroxypiperidin-1-yl]propan-2-one
CID 3228845
1-(2-fluoro-5-methoxyphenyl)-4,4-dimethylcyclohexan-1-ol
CID 171366570
1-(2,5-dimethoxyphenyl)-3,3-dimethylcyclopentan-1-ol
CID 80699237
4,4-dimethyl-1-(2-methylphenyl)cycloheptan-1-ol
CID 65086146
4-fluoro-1-(2-fluorophenyl)-4-methylcyclohexan-1-amine
CID 115034996
1-(2-methoxy-3,4-dimethylphenyl)-3,3-dimethylcyclopentan-1-ol
CID 103432648
3-(2-fluorophenyl)-8-oxo-8λ4-thiabicyclo[3.2.1]octan-3-ol
CID 171965109

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(2-fluorophenyl)-3,3-dimethylcyclopentan-1-ol?
The IUPAC name of (1R)-1-(2-fluorophenyl)-3,3-dimethylcyclopentan-1-ol (CID 124512737) is (1R)-1-(2-fluorophenyl)-3,3-dimethylcyclopentan-1-ol.
What is the SMILES notation for (1R)-1-(2-fluorophenyl)-3,3-dimethylcyclopentan-1-ol?
The canonical SMILES for (1R)-1-(2-fluorophenyl)-3,3-dimethylcyclopentan-1-ol is CC1(C)CC[C@](O)(c2ccccc2F)C1.
What is the InChIKey of (1R)-1-(2-fluorophenyl)-3,3-dimethylcyclopentan-1-ol?
The InChIKey is UVGKIMPMEGYJHS-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H17FO/c1-12(2)7-8-13(15,9-12)10-5-3-4-6-11(10)14/h3-6,15H,7-9H2,1-2H3/t13-/m1/s1.
What are the key properties of (1R)-1-(2-fluorophenyl)-3,3-dimethylcyclopentan-1-ol?
(1R)-1-(2-fluorophenyl)-3,3-dimethylcyclopentan-1-ol has a molecular weight of 208.28 g/mol, XLogP of 3.22, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(2-fluorophenyl)-3,3-dimethylcyclopentan-1-ol is sourced from PubChem (CID 124512737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).