6-[(4-fluorophenyl)methyl]bicyclo[3.1.0]hexan-6-ol

C13H15FO — CID 79331044

IUPAC6-[(4-fluorophenyl)methyl]bicyclo[3.1.0]hexan-6-ol
SMILESOC1(Cc2ccc(F)cc2)C2CCCC21
InChIInChI=1S/C13H15FO/c14-10-6-4-9(5-7-10)8-13(15)11-2-1-3-12(11)13/h4-7,11-12,15H,1-3,8H2
InChIKeyHCECQNUVPXWWLC-UHFFFAOYSA-N
MW206.26 g/mol
LogP2.53
Rot. Bonds2

About 6-[(4-fluorophenyl)methyl]bicyclo[3.1.0]hexan-6-ol

6-[(4-fluorophenyl)methyl]bicyclo[3.1.0]hexan-6-ol (PubChem CID 79331044) has the molecular formula C13H15FO and a molecular weight of 206.26 g/mol. Its IUPAC name is 6-[(4-fluorophenyl)methyl]bicyclo[3.1.0]hexan-6-ol.

Molecular Properties

Compound Name6-[(4-fluorophenyl)methyl]bicyclo[3.1.0]hexan-6-ol
PubChem CID79331044
Molecular FormulaC13H15FO
Molecular Weight206.26 g/mol
Exact Mass206.11
IUPAC Name6-[(4-fluorophenyl)methyl]bicyclo[3.1.0]hexan-6-ol
SMILESOC1(Cc2ccc(F)cc2)C2CCCC21
InChIInChI=1S/C13H15FO/c14-10-6-4-9(5-7-10)8-13(15)11-2-1-3-12(11)13/h4-7,11-12,15H,1-3,8H2
InChIKeyHCECQNUVPXWWLC-UHFFFAOYSA-N
XLogP2.53
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.26
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-[(4-methoxyphenyl)methyl]bicyclo[3.1.0]hexan-6-ol
CID 79331242
6-(naphthalen-2-ylmethyl)bicyclo[3.1.0]hexan-6-ol
CID 79330727
3-[(4-fluorophenyl)methyl]-8-azabicyclo[3.2.1]octan-3-ol
CID 54595081
8-[(4-fluorophenyl)methyl]tricyclo[5.2.1.02,6]decan-8-ol
CID 60799197
7-[(3,4-dichlorophenyl)methyl]bicyclo[4.1.0]heptan-7-ol
CID 79331257
6-[(3-bromophenyl)methyl]bicyclo[3.1.0]hexan-6-ol
CID 79331771
1-[(4-fluorophenyl)methyl]-3-(2-methylpropyl)cyclohexan-1-ol
CID 107429768
1-[(4-fluorophenyl)methyl]-2-methylcyclopropan-1-ol
CID 79333953
3-[(4-fluorophenyl)methyl]-1-methylazetidin-3-ol
CID 83818582
4-[(4-fluorophenyl)methyl]-1-methylcyclohexan-1-ol
CID 141062889
1-fluoro-4-[(1-fluorocyclopentyl)methyl]benzene
CID 84720734
1-[(4-fluorophenyl)methyl]-3-methylcyclohexan-1-amine
CID 60798898

Frequently Asked Questions

What is the IUPAC name of 6-[(4-fluorophenyl)methyl]bicyclo[3.1.0]hexan-6-ol?
The IUPAC name of 6-[(4-fluorophenyl)methyl]bicyclo[3.1.0]hexan-6-ol (CID 79331044) is 6-[(4-fluorophenyl)methyl]bicyclo[3.1.0]hexan-6-ol.
What is the SMILES notation for 6-[(4-fluorophenyl)methyl]bicyclo[3.1.0]hexan-6-ol?
The canonical SMILES for 6-[(4-fluorophenyl)methyl]bicyclo[3.1.0]hexan-6-ol is OC1(Cc2ccc(F)cc2)C2CCCC21.
What is the InChIKey of 6-[(4-fluorophenyl)methyl]bicyclo[3.1.0]hexan-6-ol?
The InChIKey is HCECQNUVPXWWLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15FO/c14-10-6-4-9(5-7-10)8-13(15)11-2-1-3-12(11)13/h4-7,11-12,15H,1-3,8H2.
What are the key properties of 6-[(4-fluorophenyl)methyl]bicyclo[3.1.0]hexan-6-ol?
6-[(4-fluorophenyl)methyl]bicyclo[3.1.0]hexan-6-ol has a molecular weight of 206.26 g/mol, XLogP of 2.53, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4-fluorophenyl)methyl]bicyclo[3.1.0]hexan-6-ol is sourced from PubChem (CID 79331044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).