(2S,3S)-1-cyclohexyl-2-[(2-fluorophenyl)methyl]piperidin-3-ol

C18H26FNO — CID 155992539

IUPAC(2S,3S)-1-cyclohexyl-2-[(2-fluorophenyl)methyl]piperidin-3-ol
SMILESO[C@H]1CCCN(C2CCCCC2)[C@H]1Cc1ccccc1F
InChIInChI=1S/C18H26FNO/c19-16-10-5-4-7-14(16)13-17-18(21)11-6-12-20(17)15-8-2-1-3-9-15/h4-5,7,10,15,17-18,21H,1-3,6,8-9,11-13H2/t17-,18-/m0/s1
InChIKeyOPAMUFXWHSYEBC-ROUUACIJSA-N
MW291.41 g/mol
LogP3.53
Rot. Bonds3

About (2S,3S)-1-cyclohexyl-2-[(2-fluorophenyl)methyl]piperidin-3-ol

(2S,3S)-1-cyclohexyl-2-[(2-fluorophenyl)methyl]piperidin-3-ol (PubChem CID 155992539) has the molecular formula C18H26FNO and a molecular weight of 291.41 g/mol. Its IUPAC name is (2S,3S)-1-cyclohexyl-2-[(2-fluorophenyl)methyl]piperidin-3-ol.

Molecular Properties

Compound Name(2S,3S)-1-cyclohexyl-2-[(2-fluorophenyl)methyl]piperidin-3-ol
PubChem CID155992539
Molecular FormulaC18H26FNO
Molecular Weight291.41 g/mol
Exact Mass291.20
IUPAC Name(2S,3S)-1-cyclohexyl-2-[(2-fluorophenyl)methyl]piperidin-3-ol
SMILESO[C@H]1CCCN(C2CCCCC2)[C@H]1Cc1ccccc1F
InChIInChI=1S/C18H26FNO/c19-16-10-5-4-7-14(16)13-17-18(21)11-6-12-20(17)15-8-2-1-3-9-15/h4-5,7,10,15,17-18,21H,1-3,6,8-9,11-13H2/t17-,18-/m0/s1
InChIKeyOPAMUFXWHSYEBC-ROUUACIJSA-N
XLogP3.53
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.41
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2S,3S)-1-cyclohexyl-2-[(2-fluorophenyl)methyl]piperidin-3-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

(2S,3S)-2-[(4-chlorophenyl)methyl]-1-cyclohexylpiperidin-3-ol
CID 155992534
1-cyclopentyl-4-[(2-fluorophenyl)methyl]piperazine
CID 740956
2-[(2-fluorophenyl)methyl]-1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepine
CID 49234263
1-(cyclobutylmethyl)-2-fluorobenzene
CID 89050192
1-(4-cyclohexylpiperazin-1-yl)-2-(2-fluorophenyl)ethanone
CID 113073065
2-[2-(2-fluorophenyl)ethyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
CID 79930326
1-[(2-bromocyclohexyl)methyl]-2-fluorobenzene
CID 63471632
1-[(2-fluorophenyl)methyl]piperidin-4-ol
CID 10242192
(5R)-8-[(2-fluorophenyl)methyl]-8-azabicyclo[3.2.1]octane
CID 66807176
1-[(2-fluorophenyl)methyl]azepane;oxalic acid
CID 163328098
2-[4-[(2-fluorophenyl)methyl]piperidin-1-yl]acetamide
CID 75370712
(2R)-1-[1-[3-(2-fluorophenyl)propanoyl]piperidin-4-yl]pyrrolidine-2-carboxamide
CID 94812898

Frequently Asked Questions

What is the IUPAC name of (2S,3S)-1-cyclohexyl-2-[(2-fluorophenyl)methyl]piperidin-3-ol?
The IUPAC name of (2S,3S)-1-cyclohexyl-2-[(2-fluorophenyl)methyl]piperidin-3-ol (CID 155992539) is (2S,3S)-1-cyclohexyl-2-[(2-fluorophenyl)methyl]piperidin-3-ol.
What is the SMILES notation for (2S,3S)-1-cyclohexyl-2-[(2-fluorophenyl)methyl]piperidin-3-ol?
The canonical SMILES for (2S,3S)-1-cyclohexyl-2-[(2-fluorophenyl)methyl]piperidin-3-ol is O[C@H]1CCCN(C2CCCCC2)[C@H]1Cc1ccccc1F.
What is the InChIKey of (2S,3S)-1-cyclohexyl-2-[(2-fluorophenyl)methyl]piperidin-3-ol?
The InChIKey is OPAMUFXWHSYEBC-ROUUACIJSA-N. The full InChI is InChI=1S/C18H26FNO/c19-16-10-5-4-7-14(16)13-17-18(21)11-6-12-20(17)15-8-2-1-3-9-15/h4-5,7,10,15,17-18,21H,1-3,6,8-9,11-13H2/t17-,18-/m0/s1.
What are the key properties of (2S,3S)-1-cyclohexyl-2-[(2-fluorophenyl)methyl]piperidin-3-ol?
(2S,3S)-1-cyclohexyl-2-[(2-fluorophenyl)methyl]piperidin-3-ol has a molecular weight of 291.41 g/mol, XLogP of 3.53, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3S)-1-cyclohexyl-2-[(2-fluorophenyl)methyl]piperidin-3-ol is sourced from PubChem (CID 155992539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).