[(2S)-6,6-dimethylpiperidin-2-yl]-(2-fluorophenyl)methanol

C14H20FNO — CID 155126963

IUPAC[(2S)-6,6-dimethylpiperidin-2-yl]-(2-fluorophenyl)methanol
SMILESCC1(C)CCC[C@@H](C(O)c2ccccc2F)N1
InChIInChI=1S/C14H20FNO/c1-14(2)9-5-8-12(16-14)13(17)10-6-3-4-7-11(10)15/h3-4,6-7,12-13,16-17H,5,8-9H2,1-2H3/t12-,13?/m0/s1
InChIKeyHIBPADUTUROJGI-UEWDXFNNSA-N
MW237.32 g/mol
LogP2.78
Rot. Bonds2

About [(2S)-6,6-dimethylpiperidin-2-yl]-(2-fluorophenyl)methanol

[(2S)-6,6-dimethylpiperidin-2-yl]-(2-fluorophenyl)methanol (PubChem CID 155126963) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is [(2S)-6,6-dimethylpiperidin-2-yl]-(2-fluorophenyl)methanol.

Molecular Properties

Compound Name[(2S)-6,6-dimethylpiperidin-2-yl]-(2-fluorophenyl)methanol
PubChem CID155126963
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC Name[(2S)-6,6-dimethylpiperidin-2-yl]-(2-fluorophenyl)methanol
SMILESCC1(C)CCC[C@@H](C(O)c2ccccc2F)N1
InChIInChI=1S/C14H20FNO/c1-14(2)9-5-8-12(16-14)13(17)10-6-3-4-7-11(10)15/h3-4,6-7,12-13,16-17H,5,8-9H2,1-2H3/t12-,13?/m0/s1
InChIKeyHIBPADUTUROJGI-UEWDXFNNSA-N
XLogP2.78
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [(2S)-6,6-dimethylpiperidin-2-yl]-(2-fluorophenyl)methanol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [(2S)-6,6-dimethylpiperidin-2-yl]-(2-fluorophenyl)methanol?
The IUPAC name of [(2S)-6,6-dimethylpiperidin-2-yl]-(2-fluorophenyl)methanol (CID 155126963) is [(2S)-6,6-dimethylpiperidin-2-yl]-(2-fluorophenyl)methanol.
What is the SMILES notation for [(2S)-6,6-dimethylpiperidin-2-yl]-(2-fluorophenyl)methanol?
The canonical SMILES for [(2S)-6,6-dimethylpiperidin-2-yl]-(2-fluorophenyl)methanol is CC1(C)CCC[C@@H](C(O)c2ccccc2F)N1.
What is the InChIKey of [(2S)-6,6-dimethylpiperidin-2-yl]-(2-fluorophenyl)methanol?
The InChIKey is HIBPADUTUROJGI-UEWDXFNNSA-N. The full InChI is InChI=1S/C14H20FNO/c1-14(2)9-5-8-12(16-14)13(17)10-6-3-4-7-11(10)15/h3-4,6-7,12-13,16-17H,5,8-9H2,1-2H3/t12-,13?/m0/s1.
What are the key properties of [(2S)-6,6-dimethylpiperidin-2-yl]-(2-fluorophenyl)methanol?
[(2S)-6,6-dimethylpiperidin-2-yl]-(2-fluorophenyl)methanol has a molecular weight of 237.32 g/mol, XLogP of 2.78, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-6,6-dimethylpiperidin-2-yl]-(2-fluorophenyl)methanol is sourced from PubChem (CID 155126963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).