5-fluoro-2,4-dimethylcyclohexan-1-ol

C8H15FO — CID 138514168

IUPAC5-fluoro-2,4-dimethylcyclohexan-1-ol
SMILESCC1CC(C)C(F)CC1O
InChIInChI=1S/C8H15FO/c1-5-3-6(2)8(10)4-7(5)9/h5-8,10H,3-4H2,1-2H3
InChIKeyLWIWZRPYUJXLFQ-UHFFFAOYSA-N
MW146.21 g/mol
LogP1.75
Rot. Bonds

About 5-fluoro-2,4-dimethylcyclohexan-1-ol

5-fluoro-2,4-dimethylcyclohexan-1-ol (PubChem CID 138514168) has the molecular formula C8H15FO and a molecular weight of 146.21 g/mol. Its IUPAC name is 5-fluoro-2,4-dimethylcyclohexan-1-ol.

Molecular Properties

Compound Name5-fluoro-2,4-dimethylcyclohexan-1-ol
PubChem CID138514168
Molecular FormulaC8H15FO
Molecular Weight146.21 g/mol
Exact Mass146.11
IUPAC Name5-fluoro-2,4-dimethylcyclohexan-1-ol
SMILESCC1CC(C)C(F)CC1O
InChIInChI=1S/C8H15FO/c1-5-3-6(2)8(10)4-7(5)9/h5-8,10H,3-4H2,1-2H3
InChIKeyLWIWZRPYUJXLFQ-UHFFFAOYSA-N
XLogP1.75
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.21
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2,4-dimethylcyclohexan-1-ol?
The IUPAC name of 5-fluoro-2,4-dimethylcyclohexan-1-ol (CID 138514168) is 5-fluoro-2,4-dimethylcyclohexan-1-ol.
What is the SMILES notation for 5-fluoro-2,4-dimethylcyclohexan-1-ol?
The canonical SMILES for 5-fluoro-2,4-dimethylcyclohexan-1-ol is CC1CC(C)C(F)CC1O.
What is the InChIKey of 5-fluoro-2,4-dimethylcyclohexan-1-ol?
The InChIKey is LWIWZRPYUJXLFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15FO/c1-5-3-6(2)8(10)4-7(5)9/h5-8,10H,3-4H2,1-2H3.
What are the key properties of 5-fluoro-2,4-dimethylcyclohexan-1-ol?
5-fluoro-2,4-dimethylcyclohexan-1-ol has a molecular weight of 146.21 g/mol, XLogP of 1.75, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2,4-dimethylcyclohexan-1-ol is sourced from PubChem (CID 138514168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).