1-[1-[4-fluoro-2-[(1S)-1-hydroxyethyl]-5-methylphenyl]piperidin-4-yl]ethanol

C16H24FNO2 — CID 106836529

IUPAC1-[1-[4-fluoro-2-[(1S)-1-hydroxyethyl]-5-methylphenyl]piperidin-4-yl]ethanol
SMILESCc1cc(N2CCC(C(C)O)CC2)c([C@H](C)O)cc1F
InChIInChI=1S/C16H24FNO2/c1-10-8-16(14(12(3)20)9-15(10)17)18-6-4-13(5-7-18)11(2)19/h8-9,11-13,19-20H,4-7H2,1-3H3/t11?,12-/m0/s1
InChIKeyGHQBMAHOXVVFLP-KIYNQFGBSA-N
MW281.37 g/mol
LogP2.78
Rot. Bonds3

About 1-[1-[4-fluoro-2-[(1S)-1-hydroxyethyl]-5-methylphenyl]piperidin-4-yl]ethanol

1-[1-[4-fluoro-2-[(1S)-1-hydroxyethyl]-5-methylphenyl]piperidin-4-yl]ethanol (PubChem CID 106836529) has the molecular formula C16H24FNO2 and a molecular weight of 281.37 g/mol. Its IUPAC name is 1-[1-[4-fluoro-2-[(1S)-1-hydroxyethyl]-5-methylphenyl]piperidin-4-yl]ethanol.

Molecular Properties

Compound Name1-[1-[4-fluoro-2-[(1S)-1-hydroxyethyl]-5-methylphenyl]piperidin-4-yl]ethanol
PubChem CID106836529
Molecular FormulaC16H24FNO2
Molecular Weight281.37 g/mol
Exact Mass281.18
IUPAC Name1-[1-[4-fluoro-2-[(1S)-1-hydroxyethyl]-5-methylphenyl]piperidin-4-yl]ethanol
SMILESCc1cc(N2CCC(C(C)O)CC2)c([C@H](C)O)cc1F
InChIInChI=1S/C16H24FNO2/c1-10-8-16(14(12(3)20)9-15(10)17)18-6-4-13(5-7-18)11(2)19/h8-9,11-13,19-20H,4-7H2,1-3H3/t11?,12-/m0/s1
InChIKeyGHQBMAHOXVVFLP-KIYNQFGBSA-N
XLogP2.78
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.37
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[1-[4-fluoro-2-[(1S)-1-hydroxyethyl]-5-methylphenyl]piperidin-4-yl]ethanol 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

1-[1-[4-fluoro-2-(1-hydroxyethyl)-5-methylphenyl]piperidin-4-yl]ethanol
CID 106836488
1-[1-[2-(1-aminoethyl)-4-fluoro-5-methylphenyl]pyrrolidin-3-yl]ethanol
CID 112626029
1-[1-[2-fluoro-4-(1-hydroxyethyl)phenyl]piperidin-4-yl]ethanol
CID 106836510
1-[2-(3,6-dihydro-2H-pyridin-1-yl)-5-fluoro-4-methylphenyl]ethanol
CID 114411335
(1S)-1-[5-fluoro-4-methyl-2-(2-methylthiomorpholin-4-yl)phenyl]ethanol
CID 104871274
1-[4-fluoro-2-[(1R)-1-hydroxyethyl]-5-methylphenyl]-3-methylpyrrolidin-3-ol
CID 103356738
(1S)-1-[5-fluoro-4-methyl-2-(2,2,6,6-tetramethylmorpholin-4-yl)phenyl]ethanol
CID 102744674
(1R)-1-[2-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-5-fluoro-4-methylphenyl]ethanol
CID 81475263
(1S)-1-[5-fluoro-2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-4-methylphenyl]ethanol
CID 104969884
1-[2-(4-tert-butyl-3,6-dihydro-2H-pyridin-1-yl)-5-fluoro-4-methylphenyl]ethanol
CID 114460490
1-[1-(2-amino-4-bromo-5-fluorophenyl)piperidin-4-yl]ethanol
CID 106835340
(1R)-1-[5-fluoro-2-[3-(hydroxymethyl)morpholin-4-yl]-4-methylphenyl]ethanol
CID 104877449

Frequently Asked Questions

What is the IUPAC name of 1-[1-[4-fluoro-2-[(1S)-1-hydroxyethyl]-5-methylphenyl]piperidin-4-yl]ethanol?
The IUPAC name of 1-[1-[4-fluoro-2-[(1S)-1-hydroxyethyl]-5-methylphenyl]piperidin-4-yl]ethanol (CID 106836529) is 1-[1-[4-fluoro-2-[(1S)-1-hydroxyethyl]-5-methylphenyl]piperidin-4-yl]ethanol.
What is the SMILES notation for 1-[1-[4-fluoro-2-[(1S)-1-hydroxyethyl]-5-methylphenyl]piperidin-4-yl]ethanol?
The canonical SMILES for 1-[1-[4-fluoro-2-[(1S)-1-hydroxyethyl]-5-methylphenyl]piperidin-4-yl]ethanol is Cc1cc(N2CCC(C(C)O)CC2)c([C@H](C)O)cc1F.
What is the InChIKey of 1-[1-[4-fluoro-2-[(1S)-1-hydroxyethyl]-5-methylphenyl]piperidin-4-yl]ethanol?
The InChIKey is GHQBMAHOXVVFLP-KIYNQFGBSA-N. The full InChI is InChI=1S/C16H24FNO2/c1-10-8-16(14(12(3)20)9-15(10)17)18-6-4-13(5-7-18)11(2)19/h8-9,11-13,19-20H,4-7H2,1-3H3/t11?,12-/m0/s1.
What are the key properties of 1-[1-[4-fluoro-2-[(1S)-1-hydroxyethyl]-5-methylphenyl]piperidin-4-yl]ethanol?
1-[1-[4-fluoro-2-[(1S)-1-hydroxyethyl]-5-methylphenyl]piperidin-4-yl]ethanol has a molecular weight of 281.37 g/mol, XLogP of 2.78, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[4-fluoro-2-[(1S)-1-hydroxyethyl]-5-methylphenyl]piperidin-4-yl]ethanol is sourced from PubChem (CID 106836529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).