trans-(1R,2R)-2-(3-fluorophenoxy)cyclohexan-1-ol

C12H15FO2 — CID 102732532

IUPACtrans-(1R,2R)-2-(3-fluorophenoxy)cyclohexan-1-ol
SMILESO[C@@H]1CCCC[C@H]1Oc1cccc(F)c1
InChIInChI=1S/C12H15FO2/c13-9-4-3-5-10(8-9)15-12-7-2-1-6-11(12)14/h3-5,8,11-12,14H,1-2,6-7H2/t11-,12-/m1/s1
InChIKeyVATYMUAUAJJXOC-VXGBXAGGSA-N
MW210.25 g/mol
LogP2.51
Rot. Bonds2

About trans-(1R,2R)-2-(3-fluorophenoxy)cyclohexan-1-ol

trans-(1R,2R)-2-(3-fluorophenoxy)cyclohexan-1-ol (PubChem CID 102732532) has the molecular formula C12H15FO2 and a molecular weight of 210.25 g/mol. Its IUPAC name is trans-(1R,2R)-2-(3-fluorophenoxy)cyclohexan-1-ol.

Molecular Properties

Compound Nametrans-(1R,2R)-2-(3-fluorophenoxy)cyclohexan-1-ol
PubChem CID102732532
Molecular FormulaC12H15FO2
Molecular Weight210.25 g/mol
Exact Mass210.11
IUPAC Nametrans-(1R,2R)-2-(3-fluorophenoxy)cyclohexan-1-ol
SMILESO[C@@H]1CCCC[C@H]1Oc1cccc(F)c1
InChIInChI=1S/C12H15FO2/c13-9-4-3-5-10(8-9)15-12-7-2-1-6-11(12)14/h3-5,8,11-12,14H,1-2,6-7H2/t11-,12-/m1/s1
InChIKeyVATYMUAUAJJXOC-VXGBXAGGSA-N
XLogP2.51
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze trans-(1R,2R)-2-(3-fluorophenoxy)cyclohexan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

trans-(1S,2S)-2-(3-iodophenoxy)cyclohexan-1-ol
CID 102732469
2-(3-chlorophenoxy)cyclohexan-1-ol
CID 60880666
2-phenoxycyclooctan-1-ol
CID 22247671
trans-(1R,2R)-2-(3-bromophenoxy)cyclopentan-1-ol
CID 102735405
trans-(1R,2R)-2-(3-ethylphenoxy)cyclohexan-1-ol
CID 102732466
trans-(1S,2S)-2-(3-bromo-5-fluorophenoxy)cyclohexan-1-ol
CID 102732659
trans-(1R,2R)-2-(3-bromo-5-fluorophenoxy)cyclohexan-1-ol
CID 102732660
[2-(3-fluorophenoxy)cyclopentyl]methanamine
CID 43293996
trans-(1S,2S)-2-(3-fluoro-4-methylphenoxy)cyclohexan-1-ol
CID 107170041
trans-(1R,2R)-2-(4-chloro-3-fluorophenoxy)cyclohexan-1-ol
CID 102732681
2-(3-fluoro-4-methylphenoxy)cyclohexan-1-ol
CID 107170051
2-(2,5-difluorophenoxy)cyclohexan-1-ol
CID 63269274

Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-2-(3-fluorophenoxy)cyclohexan-1-ol?
The IUPAC name of trans-(1R,2R)-2-(3-fluorophenoxy)cyclohexan-1-ol (CID 102732532) is trans-(1R,2R)-2-(3-fluorophenoxy)cyclohexan-1-ol.
What is the SMILES notation for trans-(1R,2R)-2-(3-fluorophenoxy)cyclohexan-1-ol?
The canonical SMILES for trans-(1R,2R)-2-(3-fluorophenoxy)cyclohexan-1-ol is O[C@@H]1CCCC[C@H]1Oc1cccc(F)c1.
What is the InChIKey of trans-(1R,2R)-2-(3-fluorophenoxy)cyclohexan-1-ol?
The InChIKey is VATYMUAUAJJXOC-VXGBXAGGSA-N. The full InChI is InChI=1S/C12H15FO2/c13-9-4-3-5-10(8-9)15-12-7-2-1-6-11(12)14/h3-5,8,11-12,14H,1-2,6-7H2/t11-,12-/m1/s1.
What are the key properties of trans-(1R,2R)-2-(3-fluorophenoxy)cyclohexan-1-ol?
trans-(1R,2R)-2-(3-fluorophenoxy)cyclohexan-1-ol has a molecular weight of 210.25 g/mol, XLogP of 2.51, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-2-(3-fluorophenoxy)cyclohexan-1-ol is sourced from PubChem (CID 102732532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).